0 mol 19 unq 0 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 8.78293 10.9543 5.31524 11.4401 7.67038 8.4674 10.4091 4.51865 13.4721 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 8.78293 10.9543 11.4401 5.31524 7.67038 8.4674 4.51865 10.4091 13.4721 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 8.78293 10.9543 5.31524 11.4401 5.03957 7.82074 12.1187 11.0366 12.6444 numMergedOcc 0
3 mol 19 unq 1 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 8.78293 10.9543 11.4401 5.31524 5.03957 7.82074 11.0366 12.1187 12.6444 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 8.23643 6.55187 11.0832 12.3093 7.67038 8.4674 10.4091 4.51865 14.6255 numMergedOcc 0
5 mol 19 unq 2 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 8.23643 6.55187 12.3093 11.0832 7.67038 8.4674 4.51865 10.4091 14.6255 numMergedOcc 0
6 mol 19 unq 3 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 8.23643 6.55187 11.0832 12.3093 5.03957 7.82074 12.1187 11.0366 8.73972 numMergedOcc 0
7 mol 19 unq 3 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 8.23643 6.55187 12.3093 11.0832 5.03957 7.82074 11.0366 12.1187 8.73972 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 7.82528 5.14627 10.4988 4.69858 7.67038 8.4674 10.4091 4.51865 6.20943 numMergedOcc 0
9 mol 19 unq 4 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 7.82528 5.14627 4.69858 10.4988 7.67038 8.4674 4.51865 10.4091 6.20943 numMergedOcc 0
10 mol 19 unq 5 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 7.82528 5.14627 10.4988 4.69858 5.03957 7.82074 12.1187 11.0366 10.2708 numMergedOcc 0
11 mol 19 unq 5 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 7.82528 5.14627 4.69858 10.4988 5.03957 7.82074 11.0366 12.1187 10.2708 numMergedOcc 0
12 mol 19 unq 6 iso 0 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 8.78293 11.4401 5.31524 10.9543 7.67038 4.51865 10.4091 8.4674 13.4721 numMergedOcc 0
13 mol 19 unq 6 iso 1 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 8.78293 11.4401 10.9543 5.31524 7.67038 4.51865 8.4674 10.4091 13.4721 numMergedOcc 0
14 mol 19 unq 7 iso 0 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 8.23643 12.3093 11.0832 6.55187 7.67038 4.51865 10.4091 8.4674 14.6255 numMergedOcc 0
15 mol 19 unq 7 iso 1 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 8.23643 12.3093 6.55187 11.0832 7.67038 4.51865 8.4674 10.4091 14.6255 numMergedOcc 0
16 mol 19 unq 8 iso 0 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 7.82528 4.69858 10.4988 5.14627 7.67038 4.51865 10.4091 8.4674 6.20943 numMergedOcc 0
17 mol 19 unq 8 iso 1 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 7.82528 4.69858 5.14627 10.4988 7.67038 4.51865 8.4674 10.4091 6.20943 numMergedOcc 0
18 mol 58 unq 0 iso 0 dist 9.55426 6.81627 9.7274 7.32874 5.90225 5.47421 8.26899 10.3782 5.98837 4.55117 10.6169 9.4099 15.2973 11.396 13.7148 numMergedOcc 0
19 mol 58 unq 0 iso 1 dist 9.55426 7.32874 5.90225 6.81627 9.7274 5.47421 8.26899 10.3782 4.55117 5.98837 10.6169 9.4099 11.396 15.2973 13.7148 numMergedOcc 0
20 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 10.0246 6.85766 17.79 14.0127 10.6318 numMergedOcc 0
21 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 10.0246 6.85766 14.0127 17.79 10.6318 numMergedOcc 0
22 mol 73 unq 0 iso 0 dist 9.96396 9.38498 15.7123 9.75218 12.016 13.7412 8.70133 7.41074 13.4082 15.9882 5.4148 6.19304 10.2049 11.6369 4.65521 numMergedOcc 0
23 mol 73 unq 0 iso 1 dist 9.96396 9.75218 12.016 9.38498 15.7123 13.7412 8.70133 7.41074 15.9882 13.4082 5.4148 6.19304 11.6369 10.2049 4.65521 numMergedOcc 0
24 mol 73 unq 1 iso 0 dist 9.96396 9.38498 15.7123 9.75218 12.016 13.7412 8.70133 7.41074 13.4082 15.9882 14.9342 8.70481 20.257 10.1207 15.9587 numMergedOcc 0
25 mol 73 unq 1 iso 1 dist 9.96396 9.75218 12.016 9.38498 15.7123 13.7412 8.70133 7.41074 15.9882 13.4082 14.9342 8.70481 10.1207 20.257 15.9587 numMergedOcc 0
26 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 6.9948 7.97049 6.19965 11.2656 9.47876 numMergedOcc 0
27 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 6.9948 7.97049 11.2656 6.19965 9.47876 numMergedOcc 0
28 mol 85 unq 1 iso 0 dist 7.66905 7.47541 5.42586 5.73196 10.1164 6.87425 7.22293 11.6116 7.98917 6.47779 10.7229 7.95579 11.3023 15.309 13.6587 numMergedOcc 0
29 mol 85 unq 1 iso 1 dist 7.66905 5.73196 10.1164 7.47541 5.42586 6.87425 7.22293 11.6116 6.47779 7.98917 10.7229 7.95579 15.309 11.3023 13.6587 numMergedOcc 0
30 mol 85 unq 2 iso 0 dist 7.66905 7.47541 5.42586 5.73196 10.1164 6.87425 7.22293 11.6116 7.98917 6.47779 6.9948 6.19965 7.97049 11.2656 9.47876 numMergedOcc 0
31 mol 85 unq 2 iso 1 dist 7.66905 5.73196 10.1164 7.47541 5.42586 6.87425 7.22293 11.6116 6.47779 7.98917 6.9948 6.19965 11.2656 7.97049 9.47876 numMergedOcc 0
32 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 5.88134 6.65086 10.5134 6.56369 7.75343 numMergedOcc 0
33 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 5.88134 6.65086 6.56369 10.5134 7.75343 numMergedOcc 0
34 mol 100 unq 1 iso 0 dist 9.35224 9.60661 7.80879 7.17106 8.87654 11.5403 6.58204 5.69137 10.9608 5.01145 5.88134 6.56369 6.65086 10.5134 7.75343 numMergedOcc 0
35 mol 100 unq 1 iso 1 dist 9.35224 7.17106 8.87654 9.60661 7.80879 11.5403 6.58204 5.69137 5.01145 10.9608 5.88134 6.56369 10.5134 6.65086 7.75343 numMergedOcc 0
36 mol 100 unq 2 iso 0 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 8.72704 10.1589 7.2495 15.9331 8.8807 6.65086 10.1409 14.9102 10.5193 numMergedOcc 0
37 mol 100 unq 2 iso 1 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 8.72704 10.1589 15.9331 7.2495 8.8807 6.65086 14.9102 10.1409 10.5193 numMergedOcc 0
38 mol 100 unq 3 iso 0 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 8.72704 10.1589 7.2495 15.9331 12.6515 6.56369 11.8665 13.6959 15.8984 numMergedOcc 0
39 mol 100 unq 3 iso 1 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 8.72704 10.1589 15.9331 7.2495 12.6515 6.56369 13.6959 11.8665 15.8984 numMergedOcc 0
40 mol 100 unq 4 iso 0 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 8.72704 10.1589 7.2495 15.9331 13.887 9.30209 13.912 18.2109 14.8726 numMergedOcc 0
41 mol 100 unq 4 iso 1 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 8.72704 10.1589 15.9331 7.2495 13.887 9.30209 18.2109 13.912 14.8726 numMergedOcc 0
42 mol 100 unq 5 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 7.75343 15.209 10.9608 5.69137 5.33144 6.45675 10.1409 11.8665 11.8016 numMergedOcc 0
43 mol 100 unq 5 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 7.75343 15.209 5.69137 10.9608 5.33144 6.45675 11.8665 10.1409 11.8016 numMergedOcc 0
44 mol 100 unq 6 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 7.75343 15.209 10.9608 5.69137 10.1407 8.86688 14.9102 13.6959 15.6924 numMergedOcc 0
45 mol 100 unq 6 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 7.75343 15.209 5.69137 10.9608 10.1407 8.86688 13.6959 14.9102 15.6924 numMergedOcc 0
46 mol 100 unq 7 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 7.75343 15.209 10.9608 9.21622 5.33144 6.45675 10.1409 13.912 11.8016 numMergedOcc 0
47 mol 100 unq 7 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 7.75343 15.209 9.21622 10.9608 5.33144 6.45675 13.912 10.1409 11.8016 numMergedOcc 0
48 mol 100 unq 8 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 7.75343 15.209 10.9608 9.21622 10.1407 8.86688 14.9102 18.2109 15.6924 numMergedOcc 0
49 mol 100 unq 8 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 7.75343 15.209 9.21622 10.9608 10.1407 8.86688 18.2109 14.9102 15.6924 numMergedOcc 0
50 mol 100 unq 7 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 7.75343 15.209 5.69137 9.21622 5.33144 6.45675 11.8665 13.912 11.8016 numMergedOcc 0
51 mol 100 unq 7 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 7.75343 15.209 9.21622 5.69137 5.33144 6.45675 13.912 11.8665 11.8016 numMergedOcc 0
52 mol 100 unq 8 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 7.75343 15.209 5.69137 9.21622 10.1407 8.86688 13.6959 18.2109 15.6924 numMergedOcc 0
53 mol 100 unq 8 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 7.75343 15.209 9.21622 5.69137 10.1407 8.86688 18.2109 13.6959 15.6924 numMergedOcc 0
54 mol 100 unq 9 iso 0 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 7.75343 10.9608 15.209 5.69137 5.88134 9.60661 12.0662 9.35224 6.58204 numMergedOcc 0
55 mol 100 unq 9 iso 1 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 7.75343 10.9608 5.69137 15.209 5.88134 9.60661 9.35224 12.0662 6.58204 numMergedOcc 0
56 mol 100 unq 10 iso 0 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 7.75343 10.9608 15.209 9.21622 5.88134 9.60661 12.0662 10.5853 6.58204 numMergedOcc 0
57 mol 100 unq 10 iso 1 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 7.75343 10.9608 9.21622 15.209 5.88134 9.60661 10.5853 12.0662 6.58204 numMergedOcc 0
58 mol 100 unq 10 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 7.75343 10.9608 5.69137 9.21622 5.88134 9.60661 9.35224 10.5853 6.58204 numMergedOcc 0
59 mol 100 unq 10 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 7.75343 10.9608 9.21622 5.69137 5.88134 9.60661 10.5853 9.35224 6.58204 numMergedOcc 0
60 mol 100 unq 11 iso 0 dist 6.56369 7.47343 12.6515 6.65086 7.80879 8.8807 7.75343 5.69137 15.209 10.9608 5.88134 9.35224 12.0662 9.60661 6.58204 numMergedOcc 0
61 mol 100 unq 11 iso 1 dist 6.56369 6.65086 7.80879 7.47343 12.6515 8.8807 7.75343 5.69137 10.9608 15.209 5.88134 9.35224 9.60661 12.0662 6.58204 numMergedOcc 0
62 mol 100 unq 12 iso 0 dist 6.56369 7.47343 12.6515 9.30209 6.39938 13.887 7.75343 5.69137 15.209 9.21622 5.88134 9.35224 12.0662 10.5853 6.58204 numMergedOcc 0
63 mol 100 unq 12 iso 1 dist 6.56369 9.30209 6.39938 7.47343 12.6515 13.887 7.75343 5.69137 9.21622 15.209 5.88134 9.35224 10.5853 12.0662 6.58204 numMergedOcc 0
64 mol 100 unq 12 iso 0 dist 6.56369 6.65086 7.80879 9.30209 6.39938 5.38414 7.75343 5.69137 10.9608 9.21622 5.88134 9.35224 9.60661 10.5853 6.58204 numMergedOcc 0
65 mol 100 unq 12 iso 1 dist 6.56369 9.30209 6.39938 6.65086 7.80879 5.38414 7.75343 5.69137 9.21622 10.9608 5.88134 9.35224 10.5853 9.60661 6.58204 numMergedOcc 0
66 mol 115 unq 0 iso 0 dist 5.83991 7.30858 10.8507 7.88312 8.02349 11.5723 8.66155 6.09023 11.3902 4.61908 7.69052 9.33865 13.8473 6.11741 9.66954 numMergedOcc 0
67 mol 115 unq 0 iso 1 dist 5.83991 7.88312 8.02349 7.30858 10.8507 11.5723 8.66155 6.09023 4.61908 11.3902 7.69052 9.33865 6.11741 13.8473 9.66954 numMergedOcc 0
68 mol 115 unq 1 iso 0 dist 7.88312 7.30858 11.5723 5.83991 8.02349 10.8507 8.66155 4.61908 11.3902 6.09023 7.69052 6.11741 13.8473 9.33865 9.66954 numMergedOcc 0
69 mol 115 unq 1 iso 1 dist 7.88312 5.83991 8.02349 7.30858 11.5723 10.8507 8.66155 4.61908 6.09023 11.3902 7.69052 6.11741 9.33865 13.8473 9.66954 numMergedOcc 0
70 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 5.32922 5.31024 7.26382 11.0824 9.07935 numMergedOcc 0
71 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 5.32922 5.31024 11.0824 7.26382 9.07935 numMergedOcc 0
72 mol 142 unq 1 iso 0 dist 7.73169 9.2313 5.50998 8.96657 5.92693 11.1395 7.15475 7.53854 9.49653 10.3477 5.32922 7.26382 5.31024 11.0824 9.07935 numMergedOcc 0
73 mol 142 unq 1 iso 1 dist 7.73169 8.96657 5.92693 9.2313 5.50998 11.1395 7.15475 7.53854 10.3477 9.49653 5.32922 7.26382 11.0824 5.31024 9.07935 numMergedOcc 0
74 mol 152 unq 0 iso 0 dist 6.70283 8.56324 7.65448 7.16148 5.49936 10.6875 9.13561 8.25411 5.99333 7.89109 5.42328 5.87555 10.399 8.87437 12.4808 numMergedOcc 0
75 mol 152 unq 0 iso 1 dist 6.70283 7.16148 5.49936 8.56324 7.65448 10.6875 9.13561 8.25411 7.89109 5.99333 5.42328 5.87555 8.87437 10.399 12.4808 numMergedOcc 0
76 mol 152 unq 1 iso 0 dist 6.70283 8.56324 7.65448 7.16148 5.49936 10.6875 9.13561 8.25411 5.99333 7.89109 6.4896 8.67331 14.1618 8.05741 14.1119 numMergedOcc 0
77 mol 152 unq 1 iso 1 dist 6.70283 7.16148 5.49936 8.56324 7.65448 10.6875 9.13561 8.25411 7.89109 5.99333 6.4896 8.67331 8.05741 14.1618 14.1119 numMergedOcc 0
78 mol 152 unq 2 iso 0 dist 7.16148 8.56324 10.6875 6.70283 5.49936 7.65448 9.13561 7.89109 5.99333 8.25411 5.42328 8.87437 10.399 5.87555 12.4808 numMergedOcc 0
79 mol 152 unq 2 iso 1 dist 7.16148 6.70283 5.49936 8.56324 10.6875 7.65448 9.13561 7.89109 8.25411 5.99333 5.42328 8.87437 5.87555 10.399 12.4808 numMergedOcc 0
80 mol 152 unq 3 iso 0 dist 7.16148 8.56324 10.6875 6.70283 5.49936 7.65448 9.13561 7.89109 5.99333 8.25411 6.4896 8.05741 14.1618 8.67331 14.1119 numMergedOcc 0
81 mol 152 unq 3 iso 1 dist 7.16148 6.70283 5.49936 8.56324 10.6875 7.65448 9.13561 7.89109 8.25411 5.99333 6.4896 8.05741 8.67331 14.1618 14.1119 numMergedOcc 0
82 mol 156 unq 0 iso 0 dist 8.94056 7.44554 5.56175 9.83699 11.2719 8.38403 6.27641 8.67156 7.29758 4.53931 10.1658 7.66148 12.0598 15.1382 10.9818 numMergedOcc 0
83 mol 156 unq 0 iso 1 dist 8.94056 9.83699 11.2719 7.44554 5.56175 8.38403 6.27641 8.67156 4.53931 7.29758 10.1658 7.66148 15.1382 12.0598 10.9818 numMergedOcc 0
84 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 7.42466 7.652 9.92231 10.2623 7.24908 numMergedOcc 0
85 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 7.42466 7.652 10.2623 9.92231 7.24908 numMergedOcc 0
86 mol 175 unq 1 iso 0 dist 5.6234 9.0018 6.2715 6.57069 5.35493 8.16421 9.8589 10.5631 8.22779 7.5414 7.42466 9.92231 7.652 10.2623 7.24908 numMergedOcc 0
87 mol 175 unq 1 iso 1 dist 5.6234 6.57069 5.35493 9.0018 6.2715 8.16421 9.8589 10.5631 7.5414 8.22779 7.42466 9.92231 10.2623 7.652 7.24908 numMergedOcc 0
88 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 13.2049 8.03334 10.7062 14.9794 12.1309 numMergedOcc 0
89 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 13.2049 8.03334 14.9794 10.7062 12.1309 numMergedOcc 0
90 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 13.2049 8.03334 10.7062 14.9794 12.2058 numMergedOcc 0
91 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 13.2049 8.03334 14.9794 10.7062 12.2058 numMergedOcc 0
92 mol 181 unq 2 iso 0 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 6.94688 5.86342 6.25083 6.80228 10.1912 9.09537 15.0228 12.9862 14.4632 numMergedOcc 0
93 mol 181 unq 2 iso 1 dist 5.98885 9.15386 5.16002 9.1374 8.88798 12.1628 6.94688 5.86342 6.80228 6.25083 10.1912 9.09537 12.9862 15.0228 14.4632 numMergedOcc 0
94 mol 181 unq 3 iso 0 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 6.71012 9.14057 4.77278 11.6919 10.1912 9.09537 15.0228 12.9862 15.4777 numMergedOcc 0
95 mol 181 unq 3 iso 1 dist 5.98885 9.15386 5.16002 9.1374 8.88798 12.1628 6.71012 9.14057 11.6919 4.77278 10.1912 9.09537 12.9862 15.0228 15.4777 numMergedOcc 0
96 mol 224 unq 0 iso 0 dist 6.57273 8.95269 4.70378 5.78342 8.49799 11.5372 6.87664 7.12232 7.98696 5.3621 5.0744 6.60589 9.99123 9.16166 10.8259 numMergedOcc 0
97 mol 224 unq 0 iso 1 dist 6.57273 5.78342 8.49799 8.95269 4.70378 11.5372 6.87664 7.12232 5.3621 7.98696 5.0744 6.60589 9.16166 9.99123 10.8259 numMergedOcc 0
98 mol 224 unq 1 iso 0 dist 5.78342 8.95269 11.5372 6.57273 8.49799 4.70378 6.87664 5.3621 7.98696 7.12232 5.0744 9.16166 9.99123 6.60589 10.8259 numMergedOcc 0
99 mol 224 unq 1 iso 1 dist 5.78342 6.57273 8.49799 8.95269 11.5372 4.70378 6.87664 5.3621 7.12232 7.98696 5.0744 9.16166 6.60589 9.99123 10.8259 numMergedOcc 0
100 mol 224 unq 2 iso 0 dist 5.78342 8.95269 11.5372 6.57273 8.49799 4.70378 6.87664 5.3621 7.98696 7.12232 5.60236 5.81334 14.0676 10.5128 10.2775 numMergedOcc 0
101 mol 224 unq 2 iso 1 dist 5.78342 6.57273 8.49799 8.95269 11.5372 4.70378 6.87664 5.3621 7.12232 7.98696 5.60236 5.81334 10.5128 14.0676 10.2775 numMergedOcc 0
102 mol 234 unq 0 iso 0 dist 6.56247 8.34494 6.29886 9.36357 7.82322 12.1694 6.25105 11.216 10.3337 11.4315 5.88703 9.45496 12.9605 6.7625 7.85175 numMergedOcc 0
103 mol 234 unq 0 iso 1 dist 6.56247 9.36357 7.82322 8.34494 6.29886 12.1694 6.25105 11.216 11.4315 10.3337 5.88703 9.45496 6.7625 12.9605 7.85175 numMergedOcc 0
104 mol 234 unq 1 iso 0 dist 9.36357 8.34494 12.1694 6.56247 7.82322 6.29886 6.25105 11.4315 10.3337 11.216 5.88703 6.7625 12.9605 9.45496 7.85175 numMergedOcc 0
105 mol 234 unq 1 iso 1 dist 9.36357 6.56247 7.82322 8.34494 12.1694 6.29886 6.25105 11.4315 11.216 10.3337 5.88703 6.7625 9.45496 12.9605 7.85175 numMergedOcc 0
106 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 7.28249 9.81562 7.68742 6.27581 5.34718 numMergedOcc 0
107 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 7.28249 9.81562 6.27581 7.68742 5.34718 numMergedOcc 0
108 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 7.28249 9.81562 7.68742 6.27581 10.5713 numMergedOcc 0
109 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 7.28249 9.81562 6.27581 7.68742 10.5713 numMergedOcc 0
110 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 7.28249 9.81562 7.68742 13.499 5.34718 numMergedOcc 0
111 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 7.28249 9.81562 13.499 7.68742 5.34718 numMergedOcc 0
112 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 7.28249 9.81562 7.68742 13.499 10.5713 numMergedOcc 0
113 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 7.28249 9.81562 13.499 7.68742 10.5713 numMergedOcc 0
114 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 7.28249 9.81562 7.68742 11.2141 5.34718 numMergedOcc 0
115 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 7.28249 9.81562 11.2141 7.68742 5.34718 numMergedOcc 0
116 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 7.28249 9.81562 7.68742 11.2141 10.5713 numMergedOcc 0
117 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 7.28249 9.81562 11.2141 7.68742 10.5713 numMergedOcc 0
118 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 7.28249 9.81562 6.27581 13.499 5.34718 numMergedOcc 0
119 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 7.28249 9.81562 13.499 6.27581 5.34718 numMergedOcc 0
120 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 7.28249 9.81562 6.27581 13.499 10.5713 numMergedOcc 0
121 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 7.28249 9.81562 13.499 6.27581 10.5713 numMergedOcc 0
122 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 7.28249 9.81562 6.27581 11.2141 5.34718 numMergedOcc 0
123 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 7.28249 9.81562 11.2141 6.27581 5.34718 numMergedOcc 0
124 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 7.28249 9.81562 6.27581 11.2141 10.5713 numMergedOcc 0
125 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 7.28249 9.81562 11.2141 6.27581 10.5713 numMergedOcc 0
126 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 7.28249 9.81562 13.499 11.2141 5.34718 numMergedOcc 0
127 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 7.28249 9.81562 11.2141 13.499 5.34718 numMergedOcc 0
128 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 7.28249 9.81562 13.499 11.2141 10.5713 numMergedOcc 0
129 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 7.28249 9.81562 11.2141 13.499 10.5713 numMergedOcc 0
130 mol 236 unq 6 iso 0 dist 6.84306 8.03456 5.79505 9.99038 11.3368 9.90963 7.17676 11.3552 11.8759 6.04825 7.28249 7.68742 9.81562 6.27581 5.34718 numMergedOcc 0
131 mol 236 unq 6 iso 1 dist 6.84306 9.99038 11.3368 8.03456 5.79505 9.90963 7.17676 11.3552 6.04825 11.8759 7.28249 7.68742 6.27581 9.81562 5.34718 numMergedOcc 0
132 mol 236 unq 7 iso 0 dist 6.84306 8.03456 5.79505 9.99038 11.3368 9.90963 6.68463 11.6837 9.07822 8.8265 7.28249 7.68742 9.81562 6.27581 10.5713 numMergedOcc 0
133 mol 236 unq 7 iso 1 dist 6.84306 9.99038 11.3368 8.03456 5.79505 9.90963 6.68463 11.6837 8.8265 9.07822 7.28249 7.68742 6.27581 9.81562 10.5713 numMergedOcc 0
134 mol 236 unq 8 iso 0 dist 6.84306 8.03456 5.79505 9.78037 11.8739 6.96005 7.17676 11.3552 11.8759 12.6468 7.28249 7.68742 9.81562 13.499 5.34718 numMergedOcc 0
135 mol 236 unq 8 iso 1 dist 6.84306 9.78037 11.8739 8.03456 5.79505 6.96005 7.17676 11.3552 12.6468 11.8759 7.28249 7.68742 13.499 9.81562 5.34718 numMergedOcc 0
136 mol 236 unq 9 iso 0 dist 6.84306 8.03456 5.79505 9.78037 11.8739 6.96005 6.68463 11.6837 9.07822 5.80136 7.28249 7.68742 9.81562 13.499 10.5713 numMergedOcc 0
137 mol 236 unq 9 iso 1 dist 6.84306 9.78037 11.8739 8.03456 5.79505 6.96005 6.68463 11.6837 5.80136 9.07822 7.28249 7.68742 13.499 9.81562 10.5713 numMergedOcc 0
138 mol 236 unq 10 iso 0 dist 6.84306 8.03456 5.79505 8.35971 14.7998 14.2337 7.17676 11.3552 11.8759 6.40312 7.28249 7.68742 9.81562 11.2141 5.34718 numMergedOcc 0
139 mol 236 unq 10 iso 1 dist 6.84306 8.35971 14.7998 8.03456 5.79505 14.2337 7.17676 11.3552 6.40312 11.8759 7.28249 7.68742 11.2141 9.81562 5.34718 numMergedOcc 0
140 mol 236 unq 11 iso 0 dist 6.84306 8.03456 5.79505 8.35971 14.7998 14.2337 6.68463 11.6837 9.07822 6.2568 7.28249 7.68742 9.81562 11.2141 10.5713 numMergedOcc 0
141 mol 236 unq 11 iso 1 dist 6.84306 8.35971 14.7998 8.03456 5.79505 14.2337 6.68463 11.6837 6.2568 9.07822 7.28249 7.68742 11.2141 9.81562 10.5713 numMergedOcc 0
142 mol 236 unq 8 iso 0 dist 6.84306 9.99038 11.3368 9.78037 11.8739 11.1557 7.17676 11.3552 6.04825 12.6468 7.28249 7.68742 6.27581 13.499 5.34718 numMergedOcc 0
143 mol 236 unq 8 iso 1 dist 6.84306 9.78037 11.8739 9.99038 11.3368 11.1557 7.17676 11.3552 12.6468 6.04825 7.28249 7.68742 13.499 6.27581 5.34718 numMergedOcc 0
144 mol 236 unq 9 iso 0 dist 6.84306 9.99038 11.3368 9.78037 11.8739 11.1557 6.68463 11.6837 8.8265 5.80136 7.28249 7.68742 6.27581 13.499 10.5713 numMergedOcc 0
145 mol 236 unq 9 iso 1 dist 6.84306 9.78037 11.8739 9.99038 11.3368 11.1557 6.68463 11.6837 5.80136 8.8265 7.28249 7.68742 13.499 6.27581 10.5713 numMergedOcc 0
146 mol 236 unq 10 iso 0 dist 6.84306 9.99038 11.3368 8.35971 14.7998 10.7497 7.17676 11.3552 6.04825 6.40312 7.28249 7.68742 6.27581 11.2141 5.34718 numMergedOcc 0
147 mol 236 unq 10 iso 1 dist 6.84306 8.35971 14.7998 9.99038 11.3368 10.7497 7.17676 11.3552 6.40312 6.04825 7.28249 7.68742 11.2141 6.27581 5.34718 numMergedOcc 0
148 mol 236 unq 11 iso 0 dist 6.84306 9.99038 11.3368 8.35971 14.7998 10.7497 6.68463 11.6837 8.8265 6.2568 7.28249 7.68742 6.27581 11.2141 10.5713 numMergedOcc 0
149 mol 236 unq 11 iso 1 dist 6.84306 8.35971 14.7998 9.99038 11.3368 10.7497 6.68463 11.6837 6.2568 8.8265 7.28249 7.68742 11.2141 6.27581 10.5713 numMergedOcc 0
150 mol 236 unq 10 iso 0 dist 6.84306 9.78037 11.8739 8.35971 14.7998 12.0369 7.17676 11.3552 12.6468 6.40312 7.28249 7.68742 13.499 11.2141 5.34718 numMergedOcc 0
151 mol 236 unq 10 iso 1 dist 6.84306 8.35971 14.7998 9.78037 11.8739 12.0369 7.17676 11.3552 6.40312 12.6468 7.28249 7.68742 11.2141 13.499 5.34718 numMergedOcc 0
152 mol 236 unq 11 iso 0 dist 6.84306 9.78037 11.8739 8.35971 14.7998 12.0369 6.68463 11.6837 5.80136 6.2568 7.28249 7.68742 13.499 11.2141 10.5713 numMergedOcc 0
153 mol 236 unq 11 iso 1 dist 6.84306 8.35971 14.7998 9.78037 11.8739 12.0369 6.68463 11.6837 6.2568 5.80136 7.28249 7.68742 11.2141 13.499 10.5713 numMergedOcc 0
154 mol 236 unq 12 iso 0 dist 9.99038 8.03456 9.90963 6.84306 11.3368 5.79505 7.17676 6.04825 11.8759 11.3552 7.28249 6.27581 9.81562 7.68742 5.34718 numMergedOcc 0
155 mol 236 unq 12 iso 1 dist 9.99038 6.84306 11.3368 8.03456 9.90963 5.79505 7.17676 6.04825 11.3552 11.8759 7.28249 6.27581 7.68742 9.81562 5.34718 numMergedOcc 0
156 mol 236 unq 13 iso 0 dist 9.99038 8.03456 9.90963 6.84306 11.3368 5.79505 6.68463 8.8265 9.07822 11.6837 7.28249 6.27581 9.81562 7.68742 10.5713 numMergedOcc 0
157 mol 236 unq 13 iso 1 dist 9.99038 6.84306 11.3368 8.03456 9.90963 5.79505 6.68463 8.8265 11.6837 9.07822 7.28249 6.27581 7.68742 9.81562 10.5713 numMergedOcc 0
158 mol 236 unq 14 iso 0 dist 9.99038 8.03456 9.90963 9.78037 11.1557 6.96005 7.17676 6.04825 11.8759 12.6468 7.28249 6.27581 9.81562 13.499 5.34718 numMergedOcc 0
159 mol 236 unq 14 iso 1 dist 9.99038 9.78037 11.1557 8.03456 9.90963 6.96005 7.17676 6.04825 12.6468 11.8759 7.28249 6.27581 13.499 9.81562 5.34718 numMergedOcc 0
160 mol 236 unq 15 iso 0 dist 9.99038 8.03456 9.90963 9.78037 11.1557 6.96005 6.68463 8.8265 9.07822 5.80136 7.28249 6.27581 9.81562 13.499 10.5713 numMergedOcc 0
161 mol 236 unq 15 iso 1 dist 9.99038 9.78037 11.1557 8.03456 9.90963 6.96005 6.68463 8.8265 5.80136 9.07822 7.28249 6.27581 13.499 9.81562 10.5713 numMergedOcc 0
162 mol 236 unq 16 iso 0 dist 9.99038 8.03456 9.90963 8.35971 10.7497 14.2337 7.17676 6.04825 11.8759 6.40312 7.28249 6.27581 9.81562 11.2141 5.34718 numMergedOcc 0
163 mol 236 unq 16 iso 1 dist 9.99038 8.35971 10.7497 8.03456 9.90963 14.2337 7.17676 6.04825 6.40312 11.8759 7.28249 6.27581 11.2141 9.81562 5.34718 numMergedOcc 0
164 mol 236 unq 17 iso 0 dist 9.99038 8.03456 9.90963 8.35971 10.7497 14.2337 6.68463 8.8265 9.07822 6.2568 7.28249 6.27581 9.81562 11.2141 10.5713 numMergedOcc 0
165 mol 236 unq 17 iso 1 dist 9.99038 8.35971 10.7497 8.03456 9.90963 14.2337 6.68463 8.8265 6.2568 9.07822 7.28249 6.27581 11.2141 9.81562 10.5713 numMergedOcc 0
166 mol 236 unq 14 iso 0 dist 9.99038 6.84306 11.3368 9.78037 11.1557 11.8739 7.17676 6.04825 11.3552 12.6468 7.28249 6.27581 7.68742 13.499 5.34718 numMergedOcc 0
167 mol 236 unq 14 iso 1 dist 9.99038 9.78037 11.1557 6.84306 11.3368 11.8739 7.17676 6.04825 12.6468 11.3552 7.28249 6.27581 13.499 7.68742 5.34718 numMergedOcc 0
168 mol 236 unq 15 iso 0 dist 9.99038 6.84306 11.3368 9.78037 11.1557 11.8739 6.68463 8.8265 11.6837 5.80136 7.28249 6.27581 7.68742 13.499 10.5713 numMergedOcc 0
169 mol 236 unq 15 iso 1 dist 9.99038 9.78037 11.1557 6.84306 11.3368 11.8739 6.68463 8.8265 5.80136 11.6837 7.28249 6.27581 13.499 7.68742 10.5713 numMergedOcc 0
170 mol 236 unq 16 iso 0 dist 9.99038 6.84306 11.3368 8.35971 10.7497 14.7998 7.17676 6.04825 11.3552 6.40312 7.28249 6.27581 7.68742 11.2141 5.34718 numMergedOcc 0
171 mol 236 unq 16 iso 1 dist 9.99038 8.35971 10.7497 6.84306 11.3368 14.7998 7.17676 6.04825 6.40312 11.3552 7.28249 6.27581 11.2141 7.68742 5.34718 numMergedOcc 0
172 mol 236 unq 17 iso 0 dist 9.99038 6.84306 11.3368 8.35971 10.7497 14.7998 6.68463 8.8265 11.6837 6.2568 7.28249 6.27581 7.68742 11.2141 10.5713 numMergedOcc 0
173 mol 236 unq 17 iso 1 dist 9.99038 8.35971 10.7497 6.84306 11.3368 14.7998 6.68463 8.8265 6.2568 11.6837 7.28249 6.27581 11.2141 7.68742 10.5713 numMergedOcc 0
174 mol 236 unq 16 iso 0 dist 9.99038 9.78037 11.1557 8.35971 10.7497 12.0369 7.17676 6.04825 12.6468 6.40312 7.28249 6.27581 13.499 11.2141 5.34718 numMergedOcc 0
175 mol 236 unq 16 iso 1 dist 9.99038 8.35971 10.7497 9.78037 11.1557 12.0369 7.17676 6.04825 6.40312 12.6468 7.28249 6.27581 11.2141 13.499 5.34718 numMergedOcc 0
176 mol 236 unq 17 iso 0 dist 9.99038 9.78037 11.1557 8.35971 10.7497 12.0369 6.68463 8.8265 5.80136 6.2568 7.28249 6.27581 13.499 11.2141 10.5713 numMergedOcc 0
177 mol 236 unq 17 iso 1 dist 9.99038 8.35971 10.7497 9.78037 11.1557 12.0369 6.68463 8.8265 6.2568 5.80136 7.28249 6.27581 11.2141 13.499 10.5713 numMergedOcc 0
178 mol 236 unq 18 iso 0 dist 8.35971 8.03456 14.2337 6.84306 14.7998 5.79505 7.17676 6.40312 11.8759 11.3552 7.43758 8.04248 15.1853 13.5269 10.6445 numMergedOcc 0
179 mol 236 unq 18 iso 1 dist 8.35971 6.84306 14.7998 8.03456 14.2337 5.79505 7.17676 6.40312 11.3552 11.8759 7.43758 8.04248 13.5269 15.1853 10.6445 numMergedOcc 0
180 mol 236 unq 19 iso 0 dist 8.35971 8.03456 14.2337 6.84306 14.7998 5.79505 6.68463 6.2568 9.07822 11.6837 7.43758 8.04248 15.1853 13.5269 10.5433 numMergedOcc 0
181 mol 236 unq 19 iso 1 dist 8.35971 6.84306 14.7998 8.03456 14.2337 5.79505 6.68463 6.2568 11.6837 9.07822 7.43758 8.04248 13.5269 15.1853 10.5433 numMergedOcc 0
182 mol 236 unq 20 iso 0 dist 8.35971 8.03456 14.2337 9.99038 10.7497 9.90963 7.17676 6.40312 11.8759 6.04825 7.43758 8.04248 15.1853 15.7308 10.6445 numMergedOcc 0
183 mol 236 unq 20 iso 1 dist 8.35971 9.99038 10.7497 8.03456 14.2337 9.90963 7.17676 6.40312 6.04825 11.8759 7.43758 8.04248 15.7308 15.1853 10.6445 numMergedOcc 0
184 mol 236 unq 21 iso 0 dist 8.35971 8.03456 14.2337 9.99038 10.7497 9.90963 6.68463 6.2568 9.07822 8.8265 7.43758 8.04248 15.1853 15.7308 10.5433 numMergedOcc 0
185 mol 236 unq 21 iso 1 dist 8.35971 9.99038 10.7497 8.03456 14.2337 9.90963 6.68463 6.2568 8.8265 9.07822 7.43758 8.04248 15.7308 15.1853 10.5433 numMergedOcc 0
186 mol 236 unq 22 iso 0 dist 8.35971 8.03456 14.2337 9.78037 12.0369 6.96005 7.17676 6.40312 11.8759 12.6468 7.43758 8.04248 15.1853 14.9122 10.6445 numMergedOcc 0
187 mol 236 unq 22 iso 1 dist 8.35971 9.78037 12.0369 8.03456 14.2337 6.96005 7.17676 6.40312 12.6468 11.8759 7.43758 8.04248 14.9122 15.1853 10.6445 numMergedOcc 0
188 mol 236 unq 23 iso 0 dist 8.35971 8.03456 14.2337 9.78037 12.0369 6.96005 6.68463 6.2568 9.07822 5.80136 7.43758 8.04248 15.1853 14.9122 10.5433 numMergedOcc 0
189 mol 236 unq 23 iso 1 dist 8.35971 9.78037 12.0369 8.03456 14.2337 6.96005 6.68463 6.2568 5.80136 9.07822 7.43758 8.04248 14.9122 15.1853 10.5433 numMergedOcc 0
190 mol 236 unq 20 iso 0 dist 8.35971 6.84306 14.7998 9.99038 10.7497 11.3368 7.17676 6.40312 11.3552 6.04825 7.43758 8.04248 13.5269 15.7308 10.6445 numMergedOcc 0
191 mol 236 unq 20 iso 1 dist 8.35971 9.99038 10.7497 6.84306 14.7998 11.3368 7.17676 6.40312 6.04825 11.3552 7.43758 8.04248 15.7308 13.5269 10.6445 numMergedOcc 0
192 mol 236 unq 21 iso 0 dist 8.35971 6.84306 14.7998 9.99038 10.7497 11.3368 6.68463 6.2568 11.6837 8.8265 7.43758 8.04248 13.5269 15.7308 10.5433 numMergedOcc 0
193 mol 236 unq 21 iso 1 dist 8.35971 9.99038 10.7497 6.84306 14.7998 11.3368 6.68463 6.2568 8.8265 11.6837 7.43758 8.04248 15.7308 13.5269 10.5433 numMergedOcc 0
194 mol 236 unq 22 iso 0 dist 8.35971 6.84306 14.7998 9.78037 12.0369 11.8739 7.17676 6.40312 11.3552 12.6468 7.43758 8.04248 13.5269 14.9122 10.6445 numMergedOcc 0
195 mol 236 unq 22 iso 1 dist 8.35971 9.78037 12.0369 6.84306 14.7998 11.8739 7.17676 6.40312 12.6468 11.3552 7.43758 8.04248 14.9122 13.5269 10.6445 numMergedOcc 0
196 mol 236 unq 23 iso 0 dist 8.35971 6.84306 14.7998 9.78037 12.0369 11.8739 6.68463 6.2568 11.6837 5.80136 7.43758 8.04248 13.5269 14.9122 10.5433 numMergedOcc 0
197 mol 236 unq 23 iso 1 dist 8.35971 9.78037 12.0369 6.84306 14.7998 11.8739 6.68463 6.2568 5.80136 11.6837 7.43758 8.04248 14.9122 13.5269 10.5433 numMergedOcc 0
198 mol 236 unq 22 iso 0 dist 8.35971 9.99038 10.7497 9.78037 12.0369 11.1557 7.17676 6.40312 6.04825 12.6468 7.43758 8.04248 15.7308 14.9122 10.6445 numMergedOcc 0
199 mol 236 unq 22 iso 1 dist 8.35971 9.78037 12.0369 9.99038 10.7497 11.1557 7.17676 6.40312 12.6468 6.04825 7.43758 8.04248 14.9122 15.7308 10.6445 numMergedOcc 0
200 mol 236 unq 23 iso 0 dist 8.35971 9.99038 10.7497 9.78037 12.0369 11.1557 6.68463 6.2568 8.8265 5.80136 7.43758 8.04248 15.7308 14.9122 10.5433 numMergedOcc 0
201 mol 236 unq 23 iso 1 dist 8.35971 9.78037 12.0369 9.99038 10.7497 11.1557 6.68463 6.2568 5.80136 8.8265 7.43758 8.04248 14.9122 15.7308 10.5433 numMergedOcc 0
202 mol 236 unq 24 iso 0 dist 9.81562 7.68742 5.79505 6.27581 9.90963 11.3368 5.34718 11.8759 11.3552 6.04825 7.28249 8.03456 6.84306 9.99038 7.17676 numMergedOcc 0
203 mol 236 unq 24 iso 1 dist 9.81562 6.27581 9.90963 7.68742 5.79505 11.3368 5.34718 11.8759 6.04825 11.3552 7.28249 8.03456 9.99038 6.84306 7.17676 numMergedOcc 0
204 mol 236 unq 25 iso 0 dist 7.68742 9.81562 5.79505 6.27581 11.3368 9.90963 5.34718 11.3552 11.8759 6.04825 7.28249 6.84306 8.03456 9.99038 7.17676 numMergedOcc 0
205 mol 236 unq 25 iso 1 dist 7.68742 6.27581 11.3368 9.81562 5.79505 9.90963 5.34718 11.3552 6.04825 11.8759 7.28249 6.84306 9.99038 8.03456 7.17676 numMergedOcc 0
206 mol 236 unq 26 iso 0 dist 6.27581 9.81562 9.90963 7.68742 11.3368 5.79505 5.34718 6.04825 11.8759 11.3552 7.28249 9.99038 8.03456 6.84306 7.17676 numMergedOcc 0
207 mol 236 unq 26 iso 1 dist 6.27581 7.68742 11.3368 9.81562 9.90963 5.79505 5.34718 6.04825 11.3552 11.8759 7.28249 9.99038 6.84306 8.03456 7.17676 numMergedOcc 0
208 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 4.69778 8.13497 9.95973 10.3935 10.9591 numMergedOcc 0
209 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 4.69778 8.13497 10.3935 9.95973 10.9591 numMergedOcc 0
210 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 4.69778 8.13497 9.95973 12.6839 10.9591 numMergedOcc 0
211 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 4.69778 8.13497 12.6839 9.95973 10.9591 numMergedOcc 0
212 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 4.69778 8.13497 10.3935 12.6839 10.9591 numMergedOcc 0
213 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 4.69778 8.13497 12.6839 10.3935 10.9591 numMergedOcc 0
