0 mol 19 unq 0 iso 0 dist 7.20519 4.54938 7.34551 6.864 7.07775 5.80928 8.78293 5.31524 10.9543 11.4401 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 7.20519 6.864 7.07775 4.54938 7.34551 5.80928 8.78293 5.31524 11.4401 10.9543 numMergedOcc 0
2 mol 19 unq 0 iso 2 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 8.78293 10.9543 5.31524 11.4401 numMergedOcc 0
3 mol 19 unq 0 iso 3 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 8.78293 10.9543 11.4401 5.31524 numMergedOcc 0
4 mol 19 unq 0 iso 4 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 8.78293 11.4401 5.31524 10.9543 numMergedOcc 0
5 mol 19 unq 0 iso 5 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 8.78293 11.4401 10.9543 5.31524 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 7.20519 4.54938 7.34551 6.864 7.07775 5.80928 8.23643 11.0832 6.55187 12.3093 numMergedOcc 0
7 mol 19 unq 1 iso 1 dist 7.20519 6.864 7.07775 4.54938 7.34551 5.80928 8.23643 11.0832 12.3093 6.55187 numMergedOcc 0
8 mol 19 unq 1 iso 2 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 8.23643 6.55187 11.0832 12.3093 numMergedOcc 0
9 mol 19 unq 1 iso 3 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 8.23643 6.55187 12.3093 11.0832 numMergedOcc 0
10 mol 19 unq 1 iso 4 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 8.23643 12.3093 11.0832 6.55187 numMergedOcc 0
11 mol 19 unq 1 iso 5 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 8.23643 12.3093 6.55187 11.0832 numMergedOcc 0
12 mol 19 unq 2 iso 0 dist 7.20519 4.54938 7.34551 6.864 7.07775 5.80928 7.82528 10.4988 5.14627 4.69858 numMergedOcc 0
13 mol 19 unq 2 iso 1 dist 7.20519 6.864 7.07775 4.54938 7.34551 5.80928 7.82528 10.4988 4.69858 5.14627 numMergedOcc 0
14 mol 19 unq 2 iso 2 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 7.82528 5.14627 10.4988 4.69858 numMergedOcc 0
15 mol 19 unq 2 iso 3 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 7.82528 5.14627 4.69858 10.4988 numMergedOcc 0
16 mol 19 unq 2 iso 4 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 7.82528 4.69858 10.4988 5.14627 numMergedOcc 0
17 mol 19 unq 2 iso 5 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 7.82528 4.69858 5.14627 10.4988 numMergedOcc 0
18 mol 54 unq 0 iso 0 dist 9.5589 6.83299 5.08001 8.10861 16.3192 14.2075 5.02241 6.91765 5.06052 10.1332 numMergedOcc 0
19 mol 54 unq 0 iso 1 dist 9.5589 8.10861 16.3192 6.83299 5.08001 14.2075 5.02241 6.91765 10.1332 5.06052 numMergedOcc 0
20 mol 54 unq 0 iso 2 dist 6.83299 9.5589 5.08001 8.10861 14.2075 16.3192 5.02241 5.06052 6.91765 10.1332 numMergedOcc 0
21 mol 54 unq 0 iso 3 dist 6.83299 8.10861 14.2075 9.5589 5.08001 16.3192 5.02241 5.06052 10.1332 6.91765 numMergedOcc 0
22 mol 54 unq 0 iso 4 dist 8.10861 9.5589 16.3192 6.83299 14.2075 5.08001 5.02241 10.1332 6.91765 5.06052 numMergedOcc 0
23 mol 54 unq 0 iso 5 dist 8.10861 6.83299 14.2075 9.5589 16.3192 5.08001 5.02241 10.1332 5.06052 6.91765 numMergedOcc 0
24 mol 58 unq 0 iso 0 dist 6.81627 7.32874 5.47421 9.55426 9.7274 5.90225 8.26899 5.98837 4.55117 10.3782 numMergedOcc 0
25 mol 58 unq 0 iso 1 dist 6.81627 9.55426 9.7274 7.32874 5.47421 5.90225 8.26899 5.98837 10.3782 4.55117 numMergedOcc 0
26 mol 58 unq 0 iso 2 dist 7.32874 6.81627 5.47421 9.55426 5.90225 9.7274 8.26899 4.55117 5.98837 10.3782 numMergedOcc 0
27 mol 58 unq 0 iso 3 dist 7.32874 9.55426 5.90225 6.81627 5.47421 9.7274 8.26899 4.55117 10.3782 5.98837 numMergedOcc 0
28 mol 58 unq 0 iso 4 dist 9.55426 6.81627 9.7274 7.32874 5.90225 5.47421 8.26899 10.3782 5.98837 4.55117 numMergedOcc 0
29 mol 58 unq 0 iso 5 dist 9.55426 7.32874 5.90225 6.81627 9.7274 5.47421 8.26899 10.3782 4.55117 5.98837 numMergedOcc 0
30 mol 58 unq 1 iso 0 dist 6.86465 6.62496 5.30792 6.35756 5.35073 4.81926 9.58673 5.92889 10.2241 7.05413 numMergedOcc 0
31 mol 58 unq 1 iso 1 dist 6.86465 6.35756 5.35073 6.62496 5.30792 4.81926 9.58673 5.92889 7.05413 10.2241 numMergedOcc 0
32 mol 58 unq 1 iso 2 dist 6.62496 6.86465 5.30792 6.35756 4.81926 5.35073 9.58673 10.2241 5.92889 7.05413 numMergedOcc 0
33 mol 58 unq 1 iso 3 dist 6.62496 6.35756 4.81926 6.86465 5.30792 5.35073 9.58673 10.2241 7.05413 5.92889 numMergedOcc 0
34 mol 58 unq 1 iso 4 dist 6.35756 6.86465 5.35073 6.62496 4.81926 5.30792 9.58673 7.05413 5.92889 10.2241 numMergedOcc 0
35 mol 58 unq 1 iso 5 dist 6.35756 6.62496 4.81926 6.86465 5.35073 5.30792 9.58673 7.05413 10.2241 5.92889 numMergedOcc 0
36 mol 59 unq 0 iso 0 dist 7.71095 8.84665 12.5396 8.25513 8.19458 6.40295 8.24062 5.3525 11.0387 9.15805 numMergedOcc 0
37 mol 59 unq 0 iso 1 dist 7.71095 8.25513 8.19458 8.84665 12.5396 6.40295 8.24062 5.3525 9.15805 11.0387 numMergedOcc 0
38 mol 59 unq 0 iso 2 dist 8.84665 7.71095 12.5396 8.25513 6.40295 8.19458 8.24062 11.0387 5.3525 9.15805 numMergedOcc 0
39 mol 59 unq 0 iso 3 dist 8.84665 8.25513 6.40295 7.71095 12.5396 8.19458 8.24062 11.0387 9.15805 5.3525 numMergedOcc 0
40 mol 59 unq 0 iso 4 dist 8.25513 7.71095 8.19458 8.84665 6.40295 12.5396 8.24062 9.15805 5.3525 11.0387 numMergedOcc 0
41 mol 59 unq 0 iso 5 dist 8.25513 8.84665 6.40295 7.71095 8.19458 12.5396 8.24062 9.15805 11.0387 5.3525 numMergedOcc 0
42 mol 73 unq 0 iso 0 dist 9.38498 9.96396 15.7123 9.75218 13.7412 12.016 8.70133 13.4082 7.41074 15.9882 numMergedOcc 0
43 mol 73 unq 0 iso 1 dist 9.38498 9.75218 13.7412 9.96396 15.7123 12.016 8.70133 13.4082 15.9882 7.41074 numMergedOcc 0
44 mol 73 unq 0 iso 2 dist 9.96396 9.38498 15.7123 9.75218 12.016 13.7412 8.70133 7.41074 13.4082 15.9882 numMergedOcc 0
45 mol 73 unq 0 iso 3 dist 9.96396 9.75218 12.016 9.38498 15.7123 13.7412 8.70133 7.41074 15.9882 13.4082 numMergedOcc 0
46 mol 73 unq 0 iso 4 dist 9.75218 9.38498 13.7412 9.96396 12.016 15.7123 8.70133 15.9882 13.4082 7.41074 numMergedOcc 0
47 mol 73 unq 0 iso 5 dist 9.75218 9.96396 12.016 9.38498 13.7412 15.7123 8.70133 15.9882 7.41074 13.4082 numMergedOcc 0
48 mol 75 unq 0 iso 0 dist 7.79912 8.56639 5.64643 8.59017 10.4899 7.00674 5.15851 10.0425 11.8774 10.0372 numMergedOcc 0
49 mol 75 unq 0 iso 1 dist 7.79912 8.59017 10.4899 8.56639 5.64643 7.00674 5.15851 10.0425 10.0372 11.8774 numMergedOcc 0
50 mol 75 unq 0 iso 2 dist 8.56639 7.79912 5.64643 8.59017 7.00674 10.4899 5.15851 11.8774 10.0425 10.0372 numMergedOcc 0
51 mol 75 unq 0 iso 3 dist 8.56639 8.59017 7.00674 7.79912 5.64643 10.4899 5.15851 11.8774 10.0372 10.0425 numMergedOcc 0
52 mol 75 unq 0 iso 4 dist 8.59017 7.79912 10.4899 8.56639 7.00674 5.64643 5.15851 10.0372 10.0425 11.8774 numMergedOcc 0
53 mol 75 unq 0 iso 5 dist 8.59017 8.56639 7.00674 7.79912 10.4899 5.64643 5.15851 10.0372 11.8774 10.0425 numMergedOcc 0
54 mol 85 unq 0 iso 0 dist 7.47541 7.66905 5.42586 5.73196 6.87425 10.1164 7.22293 7.98917 11.6116 6.47779 numMergedOcc 0
55 mol 85 unq 0 iso 1 dist 7.47541 5.73196 6.87425 7.66905 5.42586 10.1164 7.22293 7.98917 6.47779 11.6116 numMergedOcc 0
56 mol 85 unq 0 iso 2 dist 7.66905 7.47541 5.42586 5.73196 10.1164 6.87425 7.22293 11.6116 7.98917 6.47779 numMergedOcc 0
57 mol 85 unq 0 iso 3 dist 7.66905 5.73196 10.1164 7.47541 5.42586 6.87425 7.22293 11.6116 6.47779 7.98917 numMergedOcc 0
58 mol 85 unq 0 iso 4 dist 5.73196 7.47541 6.87425 7.66905 10.1164 5.42586 7.22293 6.47779 7.98917 11.6116 numMergedOcc 0
59 mol 85 unq 0 iso 5 dist 5.73196 7.66905 10.1164 7.47541 6.87425 5.42586 7.22293 6.47779 11.6116 7.98917 numMergedOcc 0
60 mol 100 unq 0 iso 0 dist 9.60661 7.17106 11.5403 9.35224 7.80879 8.87654 6.58204 10.9608 5.01145 5.69137 numMergedOcc 0
61 mol 100 unq 0 iso 1 dist 9.60661 9.35224 7.80879 7.17106 11.5403 8.87654 6.58204 10.9608 5.69137 5.01145 numMergedOcc 0
62 mol 100 unq 0 iso 2 dist 7.17106 9.60661 11.5403 9.35224 8.87654 7.80879 6.58204 5.01145 10.9608 5.69137 numMergedOcc 0
63 mol 100 unq 0 iso 3 dist 7.17106 9.35224 8.87654 9.60661 11.5403 7.80879 6.58204 5.01145 5.69137 10.9608 numMergedOcc 0
64 mol 100 unq 0 iso 4 dist 9.35224 9.60661 7.80879 7.17106 8.87654 11.5403 6.58204 5.69137 10.9608 5.01145 numMergedOcc 0
65 mol 100 unq 0 iso 5 dist 9.35224 7.17106 8.87654 9.60661 7.80879 11.5403 6.58204 5.69137 5.01145 10.9608 numMergedOcc 0
66 mol 100 unq 1 iso 0 dist 6.45675 7.47343 5.33144 8.86688 9.71151 10.1407 8.72704 7.2495 10.1589 15.9331 numMergedOcc 0
67 mol 100 unq 1 iso 1 dist 6.45675 8.86688 9.71151 7.47343 5.33144 10.1407 8.72704 7.2495 15.9331 10.1589 numMergedOcc 0
68 mol 100 unq 1 iso 2 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 8.72704 10.1589 7.2495 15.9331 numMergedOcc 0
69 mol 100 unq 1 iso 3 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 8.72704 10.1589 15.9331 7.2495 numMergedOcc 0
70 mol 100 unq 1 iso 4 dist 8.86688 6.45675 9.71151 7.47343 10.1407 5.33144 8.72704 15.9331 7.2495 10.1589 numMergedOcc 0
71 mol 100 unq 1 iso 5 dist 8.86688 7.47343 10.1407 6.45675 9.71151 5.33144 8.72704 15.9331 10.1589 7.2495 numMergedOcc 0
72 mol 100 unq 2 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 7.75343 15.209 10.9608 5.69137 numMergedOcc 0
73 mol 100 unq 2 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 7.75343 15.209 5.69137 10.9608 numMergedOcc 0
74 mol 100 unq 2 iso 2 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 7.75343 10.9608 15.209 5.69137 numMergedOcc 0
75 mol 100 unq 2 iso 3 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 7.75343 10.9608 5.69137 15.209 numMergedOcc 0
76 mol 100 unq 2 iso 4 dist 6.56369 7.47343 12.6515 6.65086 7.80879 8.8807 7.75343 5.69137 15.209 10.9608 numMergedOcc 0
77 mol 100 unq 2 iso 5 dist 6.56369 6.65086 7.80879 7.47343 12.6515 8.8807 7.75343 5.69137 10.9608 15.209 numMergedOcc 0
78 mol 100 unq 3 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 7.75343 15.209 10.9608 9.21622 numMergedOcc 0
79 mol 100 unq 3 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 7.75343 15.209 9.21622 10.9608 numMergedOcc 0
80 mol 100 unq 3 iso 2 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 7.75343 10.9608 15.209 9.21622 numMergedOcc 0
81 mol 100 unq 3 iso 3 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 7.75343 10.9608 9.21622 15.209 numMergedOcc 0
82 mol 100 unq 3 iso 4 dist 9.30209 7.47343 13.887 6.65086 5.38414 8.8807 7.75343 9.21622 15.209 10.9608 numMergedOcc 0
83 mol 100 unq 3 iso 5 dist 9.30209 6.65086 5.38414 7.47343 13.887 8.8807 7.75343 9.21622 10.9608 15.209 numMergedOcc 0
84 mol 100 unq 3 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 7.75343 15.209 5.69137 9.21622 numMergedOcc 0
85 mol 100 unq 3 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 7.75343 15.209 9.21622 5.69137 numMergedOcc 0
86 mol 100 unq 3 iso 2 dist 6.56369 7.47343 12.6515 9.30209 6.39938 13.887 7.75343 5.69137 15.209 9.21622 numMergedOcc 0
87 mol 100 unq 3 iso 3 dist 6.56369 9.30209 6.39938 7.47343 12.6515 13.887 7.75343 5.69137 9.21622 15.209 numMergedOcc 0
88 mol 100 unq 3 iso 4 dist 9.30209 7.47343 13.887 6.56369 6.39938 12.6515 7.75343 9.21622 15.209 5.69137 numMergedOcc 0
89 mol 100 unq 3 iso 5 dist 9.30209 6.56369 6.39938 7.47343 13.887 12.6515 7.75343 9.21622 5.69137 15.209 numMergedOcc 0
90 mol 100 unq 3 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 7.75343 10.9608 5.69137 9.21622 numMergedOcc 0
91 mol 100 unq 3 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 7.75343 10.9608 9.21622 5.69137 numMergedOcc 0
92 mol 100 unq 3 iso 2 dist 6.56369 6.65086 7.80879 9.30209 6.39938 5.38414 7.75343 5.69137 10.9608 9.21622 numMergedOcc 0
93 mol 100 unq 3 iso 3 dist 6.56369 9.30209 6.39938 6.65086 7.80879 5.38414 7.75343 5.69137 9.21622 10.9608 numMergedOcc 0
94 mol 100 unq 3 iso 4 dist 9.30209 6.65086 5.38414 6.56369 6.39938 7.80879 7.75343 9.21622 10.9608 5.69137 numMergedOcc 0
95 mol 100 unq 3 iso 5 dist 9.30209 6.56369 6.39938 6.65086 5.38414 7.80879 7.75343 9.21622 5.69137 10.9608 numMergedOcc 0
96 mol 115 unq 0 iso 0 dist 7.30858 5.83991 10.8507 7.88312 11.5723 8.02349 8.66155 11.3902 6.09023 4.61908 numMergedOcc 0
97 mol 115 unq 0 iso 1 dist 7.30858 7.88312 11.5723 5.83991 10.8507 8.02349 8.66155 11.3902 4.61908 6.09023 numMergedOcc 0
98 mol 115 unq 0 iso 2 dist 5.83991 7.30858 10.8507 7.88312 8.02349 11.5723 8.66155 6.09023 11.3902 4.61908 numMergedOcc 0
99 mol 115 unq 0 iso 3 dist 5.83991 7.88312 8.02349 7.30858 10.8507 11.5723 8.66155 6.09023 4.61908 11.3902 numMergedOcc 0
100 mol 115 unq 0 iso 4 dist 7.88312 7.30858 11.5723 5.83991 8.02349 10.8507 8.66155 4.61908 11.3902 6.09023 numMergedOcc 0
101 mol 115 unq 0 iso 5 dist 7.88312 5.83991 8.02349 7.30858 11.5723 10.8507 8.66155 4.61908 6.09023 11.3902 numMergedOcc 0
102 mol 142 unq 0 iso 0 dist 9.2313 7.73169 5.50998 8.96657 11.1395 5.92693 7.15475 9.49653 7.53854 10.3477 numMergedOcc 0
103 mol 142 unq 0 iso 1 dist 9.2313 8.96657 11.1395 7.73169 5.50998 5.92693 7.15475 9.49653 10.3477 7.53854 numMergedOcc 0
104 mol 142 unq 0 iso 2 dist 7.73169 9.2313 5.50998 8.96657 5.92693 11.1395 7.15475 7.53854 9.49653 10.3477 numMergedOcc 0
105 mol 142 unq 0 iso 3 dist 7.73169 8.96657 5.92693 9.2313 5.50998 11.1395 7.15475 7.53854 10.3477 9.49653 numMergedOcc 0
106 mol 142 unq 0 iso 4 dist 8.96657 9.2313 11.1395 7.73169 5.92693 5.50998 7.15475 10.3477 9.49653 7.53854 numMergedOcc 0
107 mol 142 unq 0 iso 5 dist 8.96657 7.73169 5.92693 9.2313 11.1395 5.50998 7.15475 10.3477 7.53854 9.49653 numMergedOcc 0
108 mol 152 unq 0 iso 0 dist 8.56324 6.70283 7.65448 7.16148 10.6875 5.49936 9.13561 5.99333 8.25411 7.89109 numMergedOcc 0
109 mol 152 unq 0 iso 1 dist 8.56324 7.16148 10.6875 6.70283 7.65448 5.49936 9.13561 5.99333 7.89109 8.25411 numMergedOcc 0
110 mol 152 unq 0 iso 2 dist 6.70283 8.56324 7.65448 7.16148 5.49936 10.6875 9.13561 8.25411 5.99333 7.89109 numMergedOcc 0
111 mol 152 unq 0 iso 3 dist 6.70283 7.16148 5.49936 8.56324 7.65448 10.6875 9.13561 8.25411 7.89109 5.99333 numMergedOcc 0
112 mol 152 unq 0 iso 4 dist 7.16148 8.56324 10.6875 6.70283 5.49936 7.65448 9.13561 7.89109 5.99333 8.25411 numMergedOcc 0
113 mol 152 unq 0 iso 5 dist 7.16148 6.70283 5.49936 8.56324 10.6875 7.65448 9.13561 7.89109 8.25411 5.99333 numMergedOcc 0
114 mol 156 unq 0 iso 0 dist 8.34702 9.06726 6.31306 8.33171 6.56229 5.64555 7.36119 11.787 7.71144 9.22231 numMergedOcc 0
115 mol 156 unq 0 iso 1 dist 8.34702 8.33171 6.56229 9.06726 6.31306 5.64555 7.36119 11.787 9.22231 7.71144 numMergedOcc 0
116 mol 156 unq 0 iso 2 dist 9.06726 8.34702 6.31306 8.33171 5.64555 6.56229 7.36119 7.71144 11.787 9.22231 numMergedOcc 0
117 mol 156 unq 0 iso 3 dist 9.06726 8.33171 5.64555 8.34702 6.31306 6.56229 7.36119 7.71144 9.22231 11.787 numMergedOcc 0
118 mol 156 unq 0 iso 4 dist 8.33171 8.34702 6.56229 9.06726 5.64555 6.31306 7.36119 9.22231 11.787 7.71144 numMergedOcc 0
119 mol 156 unq 0 iso 5 dist 8.33171 9.06726 5.64555 8.34702 6.56229 6.31306 7.36119 9.22231 7.71144 11.787 numMergedOcc 0
120 mol 156 unq 1 iso 0 dist 7.44554 8.94056 5.56175 9.83699 8.38403 11.2719 6.27641 7.29758 8.67156 4.53931 numMergedOcc 0
121 mol 156 unq 1 iso 1 dist 7.44554 9.83699 8.38403 8.94056 5.56175 11.2719 6.27641 7.29758 4.53931 8.67156 numMergedOcc 0
122 mol 156 unq 1 iso 2 dist 8.94056 7.44554 5.56175 9.83699 11.2719 8.38403 6.27641 8.67156 7.29758 4.53931 numMergedOcc 0
123 mol 156 unq 1 iso 3 dist 8.94056 9.83699 11.2719 7.44554 5.56175 8.38403 6.27641 8.67156 4.53931 7.29758 numMergedOcc 0
124 mol 156 unq 1 iso 4 dist 9.83699 7.44554 8.38403 8.94056 11.2719 5.56175 6.27641 4.53931 7.29758 8.67156 numMergedOcc 0
125 mol 156 unq 1 iso 5 dist 9.83699 8.94056 11.2719 7.44554 8.38403 5.56175 6.27641 4.53931 8.67156 7.29758 numMergedOcc 0
126 mol 175 unq 0 iso 0 dist 9.0018 5.6234 6.2715 6.57069 8.16421 5.35493 9.8589 8.22779 10.5631 7.5414 numMergedOcc 0
127 mol 175 unq 0 iso 1 dist 9.0018 6.57069 8.16421 5.6234 6.2715 5.35493 9.8589 8.22779 7.5414 10.5631 numMergedOcc 0
128 mol 175 unq 0 iso 2 dist 5.6234 9.0018 6.2715 6.57069 5.35493 8.16421 9.8589 10.5631 8.22779 7.5414 numMergedOcc 0
129 mol 175 unq 0 iso 3 dist 5.6234 6.57069 5.35493 9.0018 6.2715 8.16421 9.8589 10.5631 7.5414 8.22779 numMergedOcc 0
130 mol 175 unq 0 iso 4 dist 6.57069 9.0018 8.16421 5.6234 5.35493 6.2715 9.8589 7.5414 8.22779 10.5631 numMergedOcc 0
131 mol 175 unq 0 iso 5 dist 6.57069 5.6234 5.35493 9.0018 8.16421 6.2715 9.8589 7.5414 10.5631 8.22779 numMergedOcc 0
132 mol 178 unq 0 iso 0 dist 6.69288 6.43573 5.34677 7.17202 11.7381 9.89739 8.96511 10.5783 5.96647 12.075 numMergedOcc 0
133 mol 178 unq 0 iso 1 dist 6.69288 7.17202 11.7381 6.43573 5.34677 9.89739 8.96511 10.5783 12.075 5.96647 numMergedOcc 0
134 mol 178 unq 0 iso 2 dist 6.43573 6.69288 5.34677 7.17202 9.89739 11.7381 8.96511 5.96647 10.5783 12.075 numMergedOcc 0
135 mol 178 unq 0 iso 3 dist 6.43573 7.17202 9.89739 6.69288 5.34677 11.7381 8.96511 5.96647 12.075 10.5783 numMergedOcc 0
136 mol 178 unq 0 iso 4 dist 7.17202 6.69288 11.7381 6.43573 9.89739 5.34677 8.96511 12.075 10.5783 5.96647 numMergedOcc 0
137 mol 178 unq 0 iso 5 dist 7.17202 6.43573 9.89739 6.69288 11.7381 5.34677 8.96511 12.075 5.96647 10.5783 numMergedOcc 0
138 mol 178 unq 1 iso 0 dist 6.69288 6.43573 5.34677 8.81551 14.0703 10.5529 8.96511 10.5783 5.96647 9.92132 numMergedOcc 0
139 mol 178 unq 1 iso 1 dist 6.69288 8.81551 14.0703 6.43573 5.34677 10.5529 8.96511 10.5783 9.92132 5.96647 numMergedOcc 0
140 mol 178 unq 1 iso 2 dist 6.43573 6.69288 5.34677 8.81551 10.5529 14.0703 8.96511 5.96647 10.5783 9.92132 numMergedOcc 0
141 mol 178 unq 1 iso 3 dist 6.43573 8.81551 10.5529 6.69288 5.34677 14.0703 8.96511 5.96647 9.92132 10.5783 numMergedOcc 0
142 mol 178 unq 1 iso 4 dist 8.81551 6.69288 14.0703 6.43573 10.5529 5.34677 8.96511 9.92132 10.5783 5.96647 numMergedOcc 0
143 mol 178 unq 1 iso 5 dist 8.81551 6.43573 10.5529 6.69288 14.0703 5.34677 8.96511 9.92132 5.96647 10.5783 numMergedOcc 0
144 mol 178 unq 1 iso 0 dist 6.69288 7.17202 11.7381 8.81551 14.0703 5.18005 8.96511 10.5783 12.075 9.92132 numMergedOcc 0
145 mol 178 unq 1 iso 1 dist 6.69288 8.81551 14.0703 7.17202 11.7381 5.18005 8.96511 10.5783 9.92132 12.075 numMergedOcc 0
146 mol 178 unq 1 iso 2 dist 7.17202 6.69288 11.7381 8.81551 5.18005 14.0703 8.96511 12.075 10.5783 9.92132 numMergedOcc 0
147 mol 178 unq 1 iso 3 dist 7.17202 8.81551 5.18005 6.69288 11.7381 14.0703 8.96511 12.075 9.92132 10.5783 numMergedOcc 0
148 mol 178 unq 1 iso 4 dist 8.81551 6.69288 14.0703 7.17202 5.18005 11.7381 8.96511 9.92132 10.5783 12.075 numMergedOcc 0
149 mol 178 unq 1 iso 5 dist 8.81551 7.17202 5.18005 6.69288 14.0703 11.7381 8.96511 9.92132 12.075 10.5783 numMergedOcc 0
150 mol 178 unq 1 iso 0 dist 6.43573 7.17202 9.89739 8.81551 10.5529 5.18005 8.96511 5.96647 12.075 9.92132 numMergedOcc 0
151 mol 178 unq 1 iso 1 dist 6.43573 8.81551 10.5529 7.17202 9.89739 5.18005 8.96511 5.96647 9.92132 12.075 numMergedOcc 0
152 mol 178 unq 1 iso 2 dist 7.17202 6.43573 9.89739 8.81551 5.18005 10.5529 8.96511 12.075 5.96647 9.92132 numMergedOcc 0
153 mol 178 unq 1 iso 3 dist 7.17202 8.81551 5.18005 6.43573 9.89739 10.5529 8.96511 12.075 9.92132 5.96647 numMergedOcc 0
154 mol 178 unq 1 iso 4 dist 8.81551 6.43573 10.5529 7.17202 5.18005 9.89739 8.96511 9.92132 5.96647 12.075 numMergedOcc 0
155 mol 178 unq 1 iso 5 dist 8.81551 7.17202 5.18005 6.43573 10.5529 9.89739 8.96511 9.92132 12.075 5.96647 numMergedOcc 0
156 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 9.15386 12.1628 5.16002 6.94688 6.25083 5.86342 6.80228 numMergedOcc 0
157 mol 181 unq 0 iso 1 dist 9.1374 9.15386 12.1628 5.98885 8.88798 5.16002 6.94688 6.25083 6.80228 5.86342 numMergedOcc 0
158 mol 181 unq 0 iso 2 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 6.94688 5.86342 6.25083 6.80228 numMergedOcc 0
159 mol 181 unq 0 iso 3 dist 5.98885 9.15386 5.16002 9.1374 8.88798 12.1628 6.94688 5.86342 6.80228 6.25083 numMergedOcc 0
160 mol 181 unq 0 iso 4 dist 9.15386 9.1374 12.1628 5.98885 5.16002 8.88798 6.94688 6.80228 6.25083 5.86342 numMergedOcc 0
161 mol 181 unq 0 iso 5 dist 9.15386 5.98885 5.16002 9.1374 12.1628 8.88798 6.94688 6.80228 5.86342 6.25083 numMergedOcc 0
162 mol 181 unq 1 iso 0 dist 9.1374 5.98885 8.88798 9.15386 12.1628 5.16002 6.71012 4.77278 9.14057 11.6919 numMergedOcc 0
163 mol 181 unq 1 iso 1 dist 9.1374 9.15386 12.1628 5.98885 8.88798 5.16002 6.71012 4.77278 11.6919 9.14057 numMergedOcc 0
164 mol 181 unq 1 iso 2 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 6.71012 9.14057 4.77278 11.6919 numMergedOcc 0
165 mol 181 unq 1 iso 3 dist 5.98885 9.15386 5.16002 9.1374 8.88798 12.1628 6.71012 9.14057 11.6919 4.77278 numMergedOcc 0
166 mol 181 unq 1 iso 4 dist 9.15386 9.1374 12.1628 5.98885 5.16002 8.88798 6.71012 11.6919 4.77278 9.14057 numMergedOcc 0
167 mol 181 unq 1 iso 5 dist 9.15386 5.98885 5.16002 9.1374 12.1628 8.88798 6.71012 11.6919 9.14057 4.77278 numMergedOcc 0
168 mol 205 unq 0 iso 0 dist 6.03031 7.26832 7.38516 7.80463 8.18714 13.8543 9.19704 8.66809 6.23291 13.231 numMergedOcc 0
169 mol 205 unq 0 iso 1 dist 6.03031 7.80463 8.18714 7.26832 7.38516 13.8543 9.19704 8.66809 13.231 6.23291 numMergedOcc 0
170 mol 205 unq 0 iso 2 dist 7.26832 6.03031 7.38516 7.80463 13.8543 8.18714 9.19704 6.23291 8.66809 13.231 numMergedOcc 0
171 mol 205 unq 0 iso 3 dist 7.26832 7.80463 13.8543 6.03031 7.38516 8.18714 9.19704 6.23291 13.231 8.66809 numMergedOcc 0
172 mol 205 unq 0 iso 4 dist 7.80463 6.03031 8.18714 7.26832 13.8543 7.38516 9.19704 13.231 8.66809 6.23291 numMergedOcc 0
173 mol 205 unq 0 iso 5 dist 7.80463 7.26832 13.8543 6.03031 8.18714 7.38516 9.19704 13.231 6.23291 8.66809 numMergedOcc 0
174 mol 214 unq 0 iso 0 dist 9.65138 7.14453 9.10746 8.85478 4.40923 11.3796 6.97182 6.16485 5.33565 8.47007 numMergedOcc 0
175 mol 214 unq 0 iso 1 dist 9.65138 8.85478 4.40923 7.14453 9.10746 11.3796 6.97182 6.16485 8.47007 5.33565 numMergedOcc 0
176 mol 214 unq 0 iso 2 dist 7.14453 9.65138 9.10746 8.85478 11.3796 4.40923 6.97182 5.33565 6.16485 8.47007 numMergedOcc 0
177 mol 214 unq 0 iso 3 dist 7.14453 8.85478 11.3796 9.65138 9.10746 4.40923 6.97182 5.33565 8.47007 6.16485 numMergedOcc 0
178 mol 214 unq 0 iso 4 dist 8.85478 9.65138 4.40923 7.14453 11.3796 9.10746 6.97182 8.47007 6.16485 5.33565 numMergedOcc 0
179 mol 214 unq 0 iso 5 dist 8.85478 7.14453 11.3796 9.65138 4.40923 9.10746 6.97182 8.47007 5.33565 6.16485 numMergedOcc 0
180 mol 214 unq 1 iso 0 dist 9.65138 7.14453 9.10746 8.85478 4.40923 11.3796 6.1175 11.5712 5.06792 12.8334 numMergedOcc 0
181 mol 214 unq 1 iso 1 dist 9.65138 8.85478 4.40923 7.14453 9.10746 11.3796 6.1175 11.5712 12.8334 5.06792 numMergedOcc 0
182 mol 214 unq 1 iso 2 dist 7.14453 9.65138 9.10746 8.85478 11.3796 4.40923 6.1175 5.06792 11.5712 12.8334 numMergedOcc 0
183 mol 214 unq 1 iso 3 dist 7.14453 8.85478 11.3796 9.65138 9.10746 4.40923 6.1175 5.06792 12.8334 11.5712 numMergedOcc 0
184 mol 214 unq 1 iso 4 dist 8.85478 9.65138 4.40923 7.14453 11.3796 9.10746 6.1175 12.8334 11.5712 5.06792 numMergedOcc 0
185 mol 214 unq 1 iso 5 dist 8.85478 7.14453 11.3796 9.65138 4.40923 9.10746 6.1175 12.8334 5.06792 11.5712 numMergedOcc 0
186 mol 222 unq 0 iso 0 dist 8.01589 7.7699 10.4579 7.21333 13.3522 5.24516 6.82208 4.8892 11.0074 12.2813 numMergedOcc 0
187 mol 222 unq 0 iso 1 dist 8.01589 7.21333 13.3522 7.7699 10.4579 5.24516 6.82208 4.8892 12.2813 11.0074 numMergedOcc 0
188 mol 222 unq 0 iso 2 dist 7.7699 8.01589 10.4579 7.21333 5.24516 13.3522 6.82208 11.0074 4.8892 12.2813 numMergedOcc 0
189 mol 222 unq 0 iso 3 dist 7.7699 7.21333 5.24516 8.01589 10.4579 13.3522 6.82208 11.0074 12.2813 4.8892 numMergedOcc 0
190 mol 222 unq 0 iso 4 dist 7.21333 8.01589 13.3522 7.7699 5.24516 10.4579 6.82208 12.2813 4.8892 11.0074 numMergedOcc 0
191 mol 222 unq 0 iso 5 dist 7.21333 7.7699 5.24516 8.01589 13.3522 10.4579 6.82208 12.2813 11.0074 4.8892 numMergedOcc 0
192 mol 224 unq 0 iso 0 dist 8.95269 6.57273 4.70378 5.78342 11.5372 8.49799 6.87664 7.98696 7.12232 5.3621 numMergedOcc 0
193 mol 224 unq 0 iso 1 dist 8.95269 5.78342 11.5372 6.57273 4.70378 8.49799 6.87664 7.98696 5.3621 7.12232 numMergedOcc 0
194 mol 224 unq 0 iso 2 dist 6.57273 8.95269 4.70378 5.78342 8.49799 11.5372 6.87664 7.12232 7.98696 5.3621 numMergedOcc 0
195 mol 224 unq 0 iso 3 dist 6.57273 5.78342 8.49799 8.95269 4.70378 11.5372 6.87664 7.12232 5.3621 7.98696 numMergedOcc 0
196 mol 224 unq 0 iso 4 dist 5.78342 8.95269 11.5372 6.57273 8.49799 4.70378 6.87664 5.3621 7.98696 7.12232 numMergedOcc 0
197 mol 224 unq 0 iso 5 dist 5.78342 6.57273 8.49799 8.95269 11.5372 4.70378 6.87664 5.3621 7.12232 7.98696 numMergedOcc 0
198 mol 234 unq 0 iso 0 dist 8.34494 6.56247 6.29886 9.36357 12.1694 7.82322 6.25105 10.3337 11.216 11.4315 numMergedOcc 0
199 mol 234 unq 0 iso 1 dist 8.34494 9.36357 12.1694 6.56247 6.29886 7.82322 6.25105 10.3337 11.4315 11.216 numMergedOcc 0
200 mol 234 unq 0 iso 2 dist 6.56247 8.34494 6.29886 9.36357 7.82322 12.1694 6.25105 11.216 10.3337 11.4315 numMergedOcc 0
201 mol 234 unq 0 iso 3 dist 6.56247 9.36357 7.82322 8.34494 6.29886 12.1694 6.25105 11.216 11.4315 10.3337 numMergedOcc 0
202 mol 234 unq 0 iso 4 dist 9.36357 8.34494 12.1694 6.56247 7.82322 6.29886 6.25105 11.4315 10.3337 11.216 numMergedOcc 0
203 mol 234 unq 0 iso 5 dist 9.36357 6.56247 7.82322 8.34494 12.1694 6.29886 6.25105 11.4315 11.216 10.3337 numMergedOcc 0
204 mol 236 unq 0 iso 0 dist 8.03456 6.84306 5.79505 9.99038 9.90963 11.3368 7.17676 11.8759 11.3552 6.04825 numMergedOcc 0
205 mol 236 unq 0 iso 1 dist 8.03456 9.99038 9.90963 6.84306 5.79505 11.3368 7.17676 11.8759 6.04825 11.3552 numMergedOcc 0
206 mol 236 unq 0 iso 2 dist 6.84306 8.03456 5.79505 9.99038 11.3368 9.90963 7.17676 11.3552 11.8759 6.04825 numMergedOcc 0
207 mol 236 unq 0 iso 3 dist 6.84306 9.99038 11.3368 8.03456 5.79505 9.90963 7.17676 11.3552 6.04825 11.8759 numMergedOcc 0
208 mol 236 unq 0 iso 4 dist 9.99038 8.03456 9.90963 6.84306 11.3368 5.79505 7.17676 6.04825 11.8759 11.3552 numMergedOcc 0
209 mol 236 unq 0 iso 5 dist 9.99038 6.84306 11.3368 8.03456 9.90963 5.79505 7.17676 6.04825 11.3552 11.8759 numMergedOcc 0
210 mol 236 unq 1 iso 0 dist 8.03456 6.84306 5.79505 9.99038 9.90963 11.3368 6.68463 9.07822 11.6837 8.8265 numMergedOcc 0
211 mol 236 unq 1 iso 1 dist 8.03456 9.99038 9.90963 6.84306 5.79505 11.3368 6.68463 9.07822 8.8265 11.6837 numMergedOcc 0
212 mol 236 unq 1 iso 2 dist 6.84306 8.03456 5.79505 9.99038 11.3368 9.90963 6.68463 11.6837 9.07822 8.8265 numMergedOcc 0
213 mol 236 unq 1 iso 3 dist 6.84306 9.99038 11.3368 8.03456 5.79505 9.90963 6.68463 11.6837 8.8265 9.07822 numMergedOcc 0
214 mol 236 unq 1 iso 4 dist 9.99038 8.03456 9.90963 6.84306 11.3368 5.79505 6.68463 8.8265 9.07822 11.6837 numMergedOcc 0
215 mol 236 unq 1 iso 5 dist 9.99038 6.84306 11.3368 8.03456 9.90963 5.79505 6.68463 8.8265 11.6837 9.07822 numMergedOcc 0
216 mol 236 unq 2 iso 0 dist 8.03456 6.84306 5.79505 9.78037 6.96005 11.8739 7.17676 11.8759 11.3552 12.6468 numMergedOcc 0
217 mol 236 unq 2 iso 1 dist 8.03456 9.78037 6.96005 6.84306 5.79505 11.8739 7.17676 11.8759 12.6468 11.3552 numMergedOcc 0
218 mol 236 unq 2 iso 2 dist 6.84306 8.03456 5.79505 9.78037 11.8739 6.96005 7.17676 11.3552 11.8759 12.6468 numMergedOcc 0
219 mol 236 unq 2 iso 3 dist 6.84306 9.78037 11.8739 8.03456 5.79505 6.96005 7.17676 11.3552 12.6468 11.8759 numMergedOcc 0
220 mol 236 unq 2 iso 4 dist 9.78037 8.03456 6.96005 6.84306 11.8739 5.79505 7.17676 12.6468 11.8759 11.3552 numMergedOcc 0
221 mol 236 unq 2 iso 5 dist 9.78037 6.84306 11.8739 8.03456 6.96005 5.79505 7.17676 12.6468 11.3552 11.8759 numMergedOcc 0
222 mol 236 unq 3 iso 0 dist 8.03456 6.84306 5.79505 9.78037 6.96005 11.8739 6.68463 9.07822 11.6837 5.80136 numMergedOcc 0
223 mol 236 unq 3 iso 1 dist 8.03456 9.78037 6.96005 6.84306 5.79505 11.8739 6.68463 9.07822 5.80136 11.6837 numMergedOcc 0
224 mol 236 unq 3 iso 2 dist 6.84306 8.03456 5.79505 9.78037 11.8739 6.96005 6.68463 11.6837 9.07822 5.80136 numMergedOcc 0
225 mol 236 unq 3 iso 3 dist 6.84306 9.78037 11.8739 8.03456 5.79505 6.96005 6.68463 11.6837 5.80136 9.07822 numMergedOcc 0
226 mol 236 unq 3 iso 4 dist 9.78037 8.03456 6.96005 6.84306 11.8739 5.79505 6.68463 5.80136 9.07822 11.6837 numMergedOcc 0
227 mol 236 unq 3 iso 5 dist 9.78037 6.84306 11.8739 8.03456 6.96005 5.79505 6.68463 5.80136 11.6837 9.07822 numMergedOcc 0
228 mol 236 unq 4 iso 0 dist 8.03456 6.84306 5.79505 8.35971 14.2337 14.7998 7.17676 11.8759 11.3552 6.40312 numMergedOcc 0
229 mol 236 unq 4 iso 1 dist 8.03456 8.35971 14.2337 6.84306 5.79505 14.7998 7.17676 11.8759 6.40312 11.3552 numMergedOcc 0
230 mol 236 unq 4 iso 2 dist 6.84306 8.03456 5.79505 8.35971 14.7998 14.2337 7.17676 11.3552 11.8759 6.40312 numMergedOcc 0
231 mol 236 unq 4 iso 3 dist 6.84306 8.35971 14.7998 8.03456 5.79505 14.2337 7.17676 11.3552 6.40312 11.8759 numMergedOcc 0
232 mol 236 unq 4 iso 4 dist 8.35971 8.03456 14.2337 6.84306 14.7998 5.79505 7.17676 6.40312 11.8759 11.3552 numMergedOcc 0
233 mol 236 unq 4 iso 5 dist 8.35971 6.84306 14.7998 8.03456 14.2337 5.79505 7.17676 6.40312 11.3552 11.8759 numMergedOcc 0
234 mol 236 unq 5 iso 0 dist 8.03456 6.84306 5.79505 8.35971 14.2337 14.7998 6.68463 9.07822 11.6837 6.2568 numMergedOcc 0
235 mol 236 unq 5 iso 1 dist 8.03456 8.35971 14.2337 6.84306 5.79505 14.7998 6.68463 9.07822 6.2568 11.6837 numMergedOcc 0
236 mol 236 unq 5 iso 2 dist 6.84306 8.03456 5.79505 8.35971 14.7998 14.2337 6.68463 11.6837 9.07822 6.2568 numMergedOcc 0
237 mol 236 unq 5 iso 3 dist 6.84306 8.35971 14.7998 8.03456 5.79505 14.2337 6.68463 11.6837 6.2568 9.07822 numMergedOcc 0
238 mol 236 unq 5 iso 4 dist 8.35971 8.03456 14.2337 6.84306 14.7998 5.79505 6.68463 6.2568 9.07822 11.6837 numMergedOcc 0
239 mol 236 unq 5 iso 5 dist 8.35971 6.84306 14.7998 8.03456 14.2337 5.79505 6.68463 6.2568 11.6837 9.07822 numMergedOcc 0
240 mol 236 unq 2 iso 0 dist 8.03456 9.99038 9.90963 9.78037 6.96005 11.1557 7.17676 11.8759 6.04825 12.6468 numMergedOcc 0
241 mol 236 unq 2 iso 1 dist 8.03456 9.78037 6.96005 9.99038 9.90963 11.1557 7.17676 11.8759 12.6468 6.04825 numMergedOcc 0
242 mol 236 unq 2 iso 2 dist 9.99038 8.03456 9.90963 9.78037 11.1557 6.96005 7.17676 6.04825 11.8759 12.6468 numMergedOcc 0
243 mol 236 unq 2 iso 3 dist 9.99038 9.78037 11.1557 8.03456 9.90963 6.96005 7.17676 6.04825 12.6468 11.8759 numMergedOcc 0
244 mol 236 unq 2 iso 4 dist 9.78037 8.03456 6.96005 9.99038 11.1557 9.90963 7.17676 12.6468 11.8759 6.04825 numMergedOcc 0
245 mol 236 unq 2 iso 5 dist 9.78037 9.99038 11.1557 8.03456 6.96005 9.90963 7.17676 12.6468 6.04825 11.8759 numMergedOcc 0
246 mol 236 unq 3 iso 0 dist 8.03456 9.99038 9.90963 9.78037 6.96005 11.1557 6.68463 9.07822 8.8265 5.80136 numMergedOcc 0
247 mol 236 unq 3 iso 1 dist 8.03456 9.78037 6.96005 9.99038 9.90963 11.1557 6.68463 9.07822 5.80136 8.8265 numMergedOcc 0
248 mol 236 unq 3 iso 2 dist 9.99038 8.03456 9.90963 9.78037 11.1557 6.96005 6.68463 8.8265 9.07822 5.80136 numMergedOcc 0
249 mol 236 unq 3 iso 3 dist 9.99038 9.78037 11.1557 8.03456 9.90963 6.96005 6.68463 8.8265 5.80136 9.07822 numMergedOcc 0
250 mol 236 unq 3 iso 4 dist 9.78037 8.03456 6.96005 9.99038 11.1557 9.90963 6.68463 5.80136 9.07822 8.8265 numMergedOcc 0
251 mol 236 unq 3 iso 5 dist 9.78037 9.99038 11.1557 8.03456 6.96005 9.90963 6.68463 5.80136 8.8265 9.07822 numMergedOcc 0
252 mol 236 unq 4 iso 0 dist 8.03456 9.99038 9.90963 8.35971 14.2337 10.7497 7.17676 11.8759 6.04825 6.40312 numMergedOcc 0
253 mol 236 unq 4 iso 1 dist 8.03456 8.35971 14.2337 9.99038 9.90963 10.7497 7.17676 11.8759 6.40312 6.04825 numMergedOcc 0
254 mol 236 unq 4 iso 2 dist 9.99038 8.03456 9.90963 8.35971 10.7497 14.2337 7.17676 6.04825 11.8759 6.40312 numMergedOcc 0
255 mol 236 unq 4 iso 3 dist 9.99038 8.35971 10.7497 8.03456 9.90963 14.2337 7.17676 6.04825 6.40312 11.8759 numMergedOcc 0
256 mol 236 unq 4 iso 4 dist 8.35971 8.03456 14.2337 9.99038 10.7497 9.90963 7.17676 6.40312 11.8759 6.04825 numMergedOcc 0
257 mol 236 unq 4 iso 5 dist 8.35971 9.99038 10.7497 8.03456 14.2337 9.90963 7.17676 6.40312 6.04825 11.8759 numMergedOcc 0
258 mol 236 unq 5 iso 0 dist 8.03456 9.99038 9.90963 8.35971 14.2337 10.7497 6.68463 9.07822 8.8265 6.2568 numMergedOcc 0
259 mol 236 unq 5 iso 1 dist 8.03456 8.35971 14.2337 9.99038 9.90963 10.7497 6.68463 9.07822 6.2568 8.8265 numMergedOcc 0
260 mol 236 unq 5 iso 2 dist 9.99038 8.03456 9.90963 8.35971 10.7497 14.2337 6.68463 8.8265 9.07822 6.2568 numMergedOcc 0
261 mol 236 unq 5 iso 3 dist 9.99038 8.35971 10.7497 8.03456 9.90963 14.2337 6.68463 8.8265 6.2568 9.07822 numMergedOcc 0
262 mol 236 unq 5 iso 4 dist 8.35971 8.03456 14.2337 9.99038 10.7497 9.90963 6.68463 6.2568 9.07822 8.8265 numMergedOcc 0
263 mol 236 unq 5 iso 5 dist 8.35971 9.99038 10.7497 8.03456 14.2337 9.90963 6.68463 6.2568 8.8265 9.07822 numMergedOcc 0
264 mol 236 unq 4 iso 0 dist 8.03456 9.78037 6.96005 8.35971 14.2337 12.0369 7.17676 11.8759 12.6468 6.40312 numMergedOcc 0
265 mol 236 unq 4 iso 1 dist 8.03456 8.35971 14.2337 9.78037 6.96005 12.0369 7.17676 11.8759 6.40312 12.6468 numMergedOcc 0
266 mol 236 unq 4 iso 2 dist 9.78037 8.03456 6.96005 8.35971 12.0369 14.2337 7.17676 12.6468 11.8759 6.40312 numMergedOcc 0
267 mol 236 unq 4 iso 3 dist 9.78037 8.35971 12.0369 8.03456 6.96005 14.2337 7.17676 12.6468 6.40312 11.8759 numMergedOcc 0
268 mol 236 unq 4 iso 4 dist 8.35971 8.03456 14.2337 9.78037 12.0369 6.96005 7.17676 6.40312 11.8759 12.6468 numMergedOcc 0
269 mol 236 unq 4 iso 5 dist 8.35971 9.78037 12.0369 8.03456 14.2337 6.96005 7.17676 6.40312 12.6468 11.8759 numMergedOcc 0
270 mol 236 unq 5 iso 0 dist 8.03456 9.78037 6.96005 8.35971 14.2337 12.0369 6.68463 9.07822 5.80136 6.2568 numMergedOcc 0
271 mol 236 unq 5 iso 1 dist 8.03456 8.35971 14.2337 9.78037 6.96005 12.0369 6.68463 9.07822 6.2568 5.80136 numMergedOcc 0
272 mol 236 unq 5 iso 2 dist 9.78037 8.03456 6.96005 8.35971 12.0369 14.2337 6.68463 5.80136 9.07822 6.2568 numMergedOcc 0
273 mol 236 unq 5 iso 3 dist 9.78037 8.35971 12.0369 8.03456 6.96005 14.2337 6.68463 5.80136 6.2568 9.07822 numMergedOcc 0
274 mol 236 unq 5 iso 4 dist 8.35971 8.03456 14.2337 9.78037 12.0369 6.96005 6.68463 6.2568 9.07822 5.80136 numMergedOcc 0
275 mol 236 unq 5 iso 5 dist 8.35971 9.78037 12.0369 8.03456 14.2337 6.96005 6.68463 6.2568 5.80136 9.07822 numMergedOcc 0
276 mol 236 unq 2 iso 0 dist 6.84306 9.99038 11.3368 9.78037 11.8739 11.1557 7.17676 11.3552 6.04825 12.6468 numMergedOcc 0
277 mol 236 unq 2 iso 1 dist 6.84306 9.78037 11.8739 9.99038 11.3368 11.1557 7.17676 11.3552 12.6468 6.04825 numMergedOcc 0
278 mol 236 unq 2 iso 2 dist 9.99038 6.84306 11.3368 9.78037 11.1557 11.8739 7.17676 6.04825 11.3552 12.6468 numMergedOcc 0
279 mol 236 unq 2 iso 3 dist 9.99038 9.78037 11.1557 6.84306 11.3368 11.8739 7.17676 6.04825 12.6468 11.3552 numMergedOcc 0
280 mol 236 unq 2 iso 4 dist 9.78037 6.84306 11.8739 9.99038 11.1557 11.3368 7.17676 12.6468 11.3552 6.04825 numMergedOcc 0
281 mol 236 unq 2 iso 5 dist 9.78037 9.99038 11.1557 6.84306 11.8739 11.3368 7.17676 12.6468 6.04825 11.3552 numMergedOcc 0
282 mol 236 unq 3 iso 0 dist 6.84306 9.99038 11.3368 9.78037 11.8739 11.1557 6.68463 11.6837 8.8265 5.80136 numMergedOcc 0
283 mol 236 unq 3 iso 1 dist 6.84306 9.78037 11.8739 9.99038 11.3368 11.1557 6.68463 11.6837 5.80136 8.8265 numMergedOcc 0
284 mol 236 unq 3 iso 2 dist 9.99038 6.84306 11.3368 9.78037 11.1557 11.8739 6.68463 8.8265 11.6837 5.80136 numMergedOcc 0
285 mol 236 unq 3 iso 3 dist 9.99038 9.78037 11.1557 6.84306 11.3368 11.8739 6.68463 8.8265 5.80136 11.6837 numMergedOcc 0
286 mol 236 unq 3 iso 4 dist 9.78037 6.84306 11.8739 9.99038 11.1557 11.3368 6.68463 5.80136 11.6837 8.8265 numMergedOcc 0
287 mol 236 unq 3 iso 5 dist 9.78037 9.99038 11.1557 6.84306 11.8739 11.3368 6.68463 5.80136 8.8265 11.6837 numMergedOcc 0
288 mol 236 unq 4 iso 0 dist 6.84306 9.99038 11.3368 8.35971 14.7998 10.7497 7.17676 11.3552 6.04825 6.40312 numMergedOcc 0
289 mol 236 unq 4 iso 1 dist 6.84306 8.35971 14.7998 9.99038 11.3368 10.7497 7.17676 11.3552 6.40312 6.04825 numMergedOcc 0
290 mol 236 unq 4 iso 2 dist 9.99038 6.84306 11.3368 8.35971 10.7497 14.7998 7.17676 6.04825 11.3552 6.40312 numMergedOcc 0
291 mol 236 unq 4 iso 3 dist 9.99038 8.35971 10.7497 6.84306 11.3368 14.7998 7.17676 6.04825 6.40312 11.3552 numMergedOcc 0
292 mol 236 unq 4 iso 4 dist 8.35971 6.84306 14.7998 9.99038 10.7497 11.3368 7.17676 6.40312 11.3552 6.04825 numMergedOcc 0
293 mol 236 unq 4 iso 5 dist 8.35971 9.99038 10.7497 6.84306 14.7998 11.3368 7.17676 6.40312 6.04825 11.3552 numMergedOcc 0
294 mol 236 unq 5 iso 0 dist 6.84306 9.99038 11.3368 8.35971 14.7998 10.7497 6.68463 11.6837 8.8265 6.2568 numMergedOcc 0
295 mol 236 unq 5 iso 1 dist 6.84306 8.35971 14.7998 9.99038 11.3368 10.7497 6.68463 11.6837 6.2568 8.8265 numMergedOcc 0
296 mol 236 unq 5 iso 2 dist 9.99038 6.84306 11.3368 8.35971 10.7497 14.7998 6.68463 8.8265 11.6837 6.2568 numMergedOcc 0
297 mol 236 unq 5 iso 3 dist 9.99038 8.35971 10.7497 6.84306 11.3368 14.7998 6.68463 8.8265 6.2568 11.6837 numMergedOcc 0
298 mol 236 unq 5 iso 4 dist 8.35971 6.84306 14.7998 9.99038 10.7497 11.3368 6.68463 6.2568 11.6837 8.8265 numMergedOcc 0
299 mol 236 unq 5 iso 5 dist 8.35971 9.99038 10.7497 6.84306 14.7998 11.3368 6.68463 6.2568 8.8265 11.6837 numMergedOcc 0
300 mol 236 unq 4 iso 0 dist 6.84306 9.78037 11.8739 8.35971 14.7998 12.0369 7.17676 11.3552 12.6468 6.40312 numMergedOcc 0
301 mol 236 unq 4 iso 1 dist 6.84306 8.35971 14.7998 9.78037 11.8739 12.0369 7.17676 11.3552 6.40312 12.6468 numMergedOcc 0
302 mol 236 unq 4 iso 2 dist 9.78037 6.84306 11.8739 8.35971 12.0369 14.7998 7.17676 12.6468 11.3552 6.40312 numMergedOcc 0
303 mol 236 unq 4 iso 3 dist 9.78037 8.35971 12.0369 6.84306 11.8739 14.7998 7.17676 12.6468 6.40312 11.3552 numMergedOcc 0
304 mol 236 unq 4 iso 4 dist 8.35971 6.84306 14.7998 9.78037 12.0369 11.8739 7.17676 6.40312 11.3552 12.6468 numMergedOcc 0
305 mol 236 unq 4 iso 5 dist 8.35971 9.78037 12.0369 6.84306 14.7998 11.8739 7.17676 6.40312 12.6468 11.3552 numMergedOcc 0
306 mol 236 unq 5 iso 0 dist 6.84306 9.78037 11.8739 8.35971 14.7998 12.0369 6.68463 11.6837 5.80136 6.2568 numMergedOcc 0
307 mol 236 unq 5 iso 1 dist 6.84306 8.35971 14.7998 9.78037 11.8739 12.0369 6.68463 11.6837 6.2568 5.80136 numMergedOcc 0
308 mol 236 unq 5 iso 2 dist 9.78037 6.84306 11.8739 8.35971 12.0369 14.7998 6.68463 5.80136 11.6837 6.2568 numMergedOcc 0
309 mol 236 unq 5 iso 3 dist 9.78037 8.35971 12.0369 6.84306 11.8739 14.7998 6.68463 5.80136 6.2568 11.6837 numMergedOcc 0
310 mol 236 unq 5 iso 4 dist 8.35971 6.84306 14.7998 9.78037 12.0369 11.8739 6.68463 6.2568 11.6837 5.80136 numMergedOcc 0
311 mol 236 unq 5 iso 5 dist 8.35971 9.78037 12.0369 6.84306 14.7998 11.8739 6.68463 6.2568 5.80136 11.6837 numMergedOcc 0
312 mol 236 unq 4 iso 0 dist 9.99038 9.78037 11.1557 8.35971 10.7497 12.0369 7.17676 6.04825 12.6468 6.40312 numMergedOcc 0
313 mol 236 unq 4 iso 1 dist 9.99038 8.35971 10.7497 9.78037 11.1557 12.0369 7.17676 6.04825 6.40312 12.6468 numMergedOcc 0
314 mol 236 unq 4 iso 2 dist 9.78037 9.99038 11.1557 8.35971 12.0369 10.7497 7.17676 12.6468 6.04825 6.40312 numMergedOcc 0
315 mol 236 unq 4 iso 3 dist 9.78037 8.35971 12.0369 9.99038 11.1557 10.7497 7.17676 12.6468 6.40312 6.04825 numMergedOcc 0
316 mol 236 unq 4 iso 4 dist 8.35971 9.99038 10.7497 9.78037 12.0369 11.1557 7.17676 6.40312 6.04825 12.6468 numMergedOcc 0
317 mol 236 unq 4 iso 5 dist 8.35971 9.78037 12.0369 9.99038 10.7497 11.1557 7.17676 6.40312 12.6468 6.04825 numMergedOcc 0
318 mol 236 unq 5 iso 0 dist 9.99038 9.78037 11.1557 8.35971 10.7497 12.0369 6.68463 8.8265 5.80136 6.2568 numMergedOcc 0
319 mol 236 unq 5 iso 1 dist 9.99038 8.35971 10.7497 9.78037 11.1557 12.0369 6.68463 8.8265 6.2568 5.80136 numMergedOcc 0
320 mol 236 unq 5 iso 2 dist 9.78037 9.99038 11.1557 8.35971 12.0369 10.7497 6.68463 5.80136 8.8265 6.2568 numMergedOcc 0
321 mol 236 unq 5 iso 3 dist 9.78037 8.35971 12.0369 9.99038 11.1557 10.7497 6.68463 5.80136 6.2568 8.8265 numMergedOcc 0
322 mol 236 unq 5 iso 4 dist 8.35971 9.99038 10.7497 9.78037 12.0369 11.1557 6.68463 6.2568 8.8265 5.80136 numMergedOcc 0
323 mol 236 unq 5 iso 5 dist 8.35971 9.78037 12.0369 9.99038 10.7497 11.1557 6.68463 6.2568 5.80136 8.8265 numMergedOcc 0
324 mol 236 unq 6 iso 0 dist 9.81562 7.68742 5.79505 6.27581 9.90963 11.3368 5.34718 11.8759 11.3552 6.04825 numMergedOcc 0
325 mol 236 unq 6 iso 1 dist 9.81562 6.27581 9.90963 7.68742 5.79505 11.3368 5.34718 11.8759 6.04825 11.3552 numMergedOcc 0
326 mol 236 unq 6 iso 2 dist 7.68742 9.81562 5.79505 6.27581 11.3368 9.90963 5.34718 11.3552 11.8759 6.04825 numMergedOcc 0
327 mol 236 unq 6 iso 3 dist 7.68742 6.27581 11.3368 9.81562 5.79505 9.90963 5.34718 11.3552 6.04825 11.8759 numMergedOcc 0
328 mol 236 unq 6 iso 4 dist 6.27581 9.81562 9.90963 7.68742 11.3368 5.79505 5.34718 6.04825 11.8759 11.3552 numMergedOcc 0
329 mol 236 unq 6 iso 5 dist 6.27581 7.68742 11.3368 9.81562 9.90963 5.79505 5.34718 6.04825 11.3552 11.8759 numMergedOcc 0
330 mol 248 unq 0 iso 0 dist 7.69895 7.21521 5.55137 8.2965 10.8081 5.86196 6.07192 6.48757 5.51827 9.29921 numMergedOcc 0
331 mol 248 unq 0 iso 1 dist 7.69895 8.2965 10.8081 7.21521 5.55137 5.86196 6.07192 6.48757 9.29921 5.51827 numMergedOcc 0
332 mol 248 unq 0 iso 2 dist 7.21521 7.69895 5.55137 8.2965 5.86196 10.8081 6.07192 5.51827 6.48757 9.29921 numMergedOcc 0
333 mol 248 unq 0 iso 3 dist 7.21521 8.2965 5.86196 7.69895 5.55137 10.8081 6.07192 5.51827 9.29921 6.48757 numMergedOcc 0
334 mol 248 unq 0 iso 4 dist 8.2965 7.69895 10.8081 7.21521 5.86196 5.55137 6.07192 9.29921 6.48757 5.51827 numMergedOcc 0
335 mol 248 unq 0 iso 5 dist 8.2965 7.21521 5.86196 7.69895 10.8081 5.55137 6.07192 9.29921 5.51827 6.48757 numMergedOcc 0
336 mol 259 unq 0 iso 0 dist 7.88519 7.84554 4.86771 7.46176 6.96053 7.64658 7.48005 11.6195 11.8736 5.79468 numMergedOcc 0
337 mol 259 unq 0 iso 1 dist 7.88519 7.46176 6.96053 7.84554 4.86771 7.64658 7.48005 11.6195 5.79468 11.8736 numMergedOcc 0
338 mol 259 unq 0 iso 2 dist 7.84554 7.88519 4.86771 7.46176 7.64658 6.96053 7.48005 11.8736 11.6195 5.79468 numMergedOcc 0
339 mol 259 unq 0 iso 3 dist 7.84554 7.46176 7.64658 7.88519 4.86771 6.96053 7.48005 11.8736 5.79468 11.6195 numMergedOcc 0
340 mol 259 unq 0 iso 4 dist 7.46176 7.88519 6.96053 7.84554 7.64658 4.86771 7.48005 5.79468 11.6195 11.8736 numMergedOcc 0
341 mol 259 unq 0 iso 5 dist 7.46176 7.84554 7.64658 7.88519 6.96053 4.86771 7.48005 5.79468 11.8736 11.6195 numMergedOcc 0
342 mol 259 unq 1 iso 0 dist 7.88519 7.84554 4.86771 9.18903 10.4881 5.87173 7.48005 11.6195 11.8736 12.6649 numMergedOcc 0
343 mol 259 unq 1 iso 1 dist 7.88519 9.18903 10.4881 7.84554 4.86771 5.87173 7.48005 11.6195 12.6649 11.8736 numMergedOcc 0
344 mol 259 unq 1 iso 2 dist 7.84554 7.88519 4.86771 9.18903 5.87173 10.4881 7.48005 11.8736 11.6195 12.6649 numMergedOcc 0
345 mol 259 unq 1 iso 3 dist 7.84554 9.18903 5.87173 7.88519 4.86771 10.4881 7.48005 11.8736 12.6649 11.6195 numMergedOcc 0
346 mol 259 unq 1 iso 4 dist 9.18903 7.88519 10.4881 7.84554 5.87173 4.86771 7.48005 12.6649 11.6195 11.8736 numMergedOcc 0
347 mol 259 unq 1 iso 5 dist 9.18903 7.84554 5.87173 7.88519 10.4881 4.86771 7.48005 12.6649 11.8736 11.6195 numMergedOcc 0
348 mol 259 unq 1 iso 0 dist 7.88519 7.46176 6.96053 9.18903 10.4881 10.5239 7.48005 11.6195 5.79468 12.6649 numMergedOcc 0
349 mol 259 unq 1 iso 1 dist 7.88519 9.18903 10.4881 7.46176 6.96053 10.5239 7.48005 11.6195 12.6649 5.79468 numMergedOcc 0
350 mol 259 unq 1 iso 2 dist 7.46176 7.88519 6.96053 9.18903 10.5239 10.4881 7.48005 5.79468 11.6195 12.6649 numMergedOcc 0
351 mol 259 unq 1 iso 3 dist 7.46176 9.18903 10.5239 7.88519 6.96053 10.4881 7.48005 5.79468 12.6649 11.6195 numMergedOcc 0
352 mol 259 unq 1 iso 4 dist 9.18903 7.88519 10.4881 7.46176 10.5239 6.96053 7.48005 12.6649 11.6195 5.79468 numMergedOcc 0
353 mol 259 unq 1 iso 5 dist 9.18903 7.46176 10.5239 7.88519 10.4881 6.96053 7.48005 12.6649 5.79468 11.6195 numMergedOcc 0
354 mol 259 unq 1 iso 0 dist 7.84554 7.46176 7.64658 9.18903 5.87173 10.5239 7.48005 11.8736 5.79468 12.6649 numMergedOcc 0
355 mol 259 unq 1 iso 1 dist 7.84554 9.18903 5.87173 7.46176 7.64658 10.5239 7.48005 11.8736 12.6649 5.79468 numMergedOcc 0
356 mol 259 unq 1 iso 2 dist 7.46176 7.84554 7.64658 9.18903 10.5239 5.87173 7.48005 5.79468 11.8736 12.6649 numMergedOcc 0
357 mol 259 unq 1 iso 3 dist 7.46176 9.18903 10.5239 7.84554 7.64658 5.87173 7.48005 5.79468 12.6649 11.8736 numMergedOcc 0
358 mol 259 unq 1 iso 4 dist 9.18903 7.84554 5.87173 7.46176 10.5239 7.64658 7.48005 12.6649 11.8736 5.79468 numMergedOcc 0
359 mol 259 unq 1 iso 5 dist 9.18903 7.46176 10.5239 7.84554 5.87173 7.64658 7.48005 12.6649 5.79468 11.8736 numMergedOcc 0
360 mol 282 unq 0 iso 0 dist 8.04483 8.76532 10.0156 6.33524 5.39891 4.66602 8.8673 10.1236 8.14825 7.36881 numMergedOcc 0
361 mol 282 unq 0 iso 1 dist 8.04483 6.33524 5.39891 8.76532 10.0156 4.66602 8.8673 10.1236 7.36881 8.14825 numMergedOcc 0
362 mol 282 unq 0 iso 2 dist 8.76532 8.04483 10.0156 6.33524 4.66602 5.39891 8.8673 8.14825 10.1236 7.36881 numMergedOcc 0
363 mol 282 unq 0 iso 3 dist 8.76532 6.33524 4.66602 8.04483 10.0156 5.39891 8.8673 8.14825 7.36881 10.1236 numMergedOcc 0
364 mol 282 unq 0 iso 4 dist 6.33524 8.04483 5.39891 8.76532 4.66602 10.0156 8.8673 7.36881 10.1236 8.14825 numMergedOcc 0
365 mol 282 unq 0 iso 5 dist 6.33524 8.76532 4.66602 8.04483 5.39891 10.0156 8.8673 7.36881 8.14825 10.1236 numMergedOcc 0
