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 6.92532 12.3486 5.18512 9.47529 15.1136 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 6.92532 12.3486 9.47529 5.18512 15.1136 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 6.92532 5.18512 12.3486 9.47529 15.1136 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 6.92532 5.18512 9.47529 12.3486 15.1136 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 6.92532 9.47529 12.3486 5.18512 15.1136 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 6.92532 9.47529 5.18512 12.3486 15.1136 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 6.92532 12.3486 5.18512 9.47529 6.87842 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 6.92532 12.3486 9.47529 5.18512 6.87842 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 6.92532 5.18512 12.3486 9.47529 6.87842 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 6.92532 5.18512 9.47529 12.3486 6.87842 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 6.92532 9.47529 12.3486 5.18512 6.87842 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 6.92532 9.47529 5.18512 12.3486 6.87842 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 6.92532 12.3486 5.18512 9.47529 6.34272 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 6.92532 12.3486 9.47529 5.18512 6.34272 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 6.92532 5.18512 12.3486 9.47529 6.34272 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 6.92532 5.18512 9.47529 12.3486 6.34272 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 6.92532 9.47529 12.3486 5.18512 6.34272 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 6.92532 9.47529 5.18512 12.3486 6.34272 numMergedOcc 0
18 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 7.04044 15.7304 8.26458 8.35241 11.2505 numMergedOcc 0
19 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 7.04044 15.7304 8.35241 8.26458 11.2505 numMergedOcc 0
20 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 7.04044 8.26458 15.7304 8.35241 11.2505 numMergedOcc 0
21 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 7.04044 8.26458 8.35241 15.7304 11.2505 numMergedOcc 0
22 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 7.04044 8.35241 15.7304 8.26458 11.2505 numMergedOcc 0
23 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 7.04044 8.35241 8.26458 15.7304 11.2505 numMergedOcc 0
24 mol 100 unq 0 iso 0 dist 6.45675 7.47343 5.33144 8.86688 9.71151 10.1407 8.72704 7.2495 10.1589 15.9331 9.00544 11.8512 14.9392 9.01214 14.6145 numMergedOcc 0
25 mol 100 unq 0 iso 1 dist 6.45675 8.86688 9.71151 7.47343 5.33144 10.1407 8.72704 7.2495 15.9331 10.1589 9.00544 11.8512 9.01214 14.9392 14.6145 numMergedOcc 0
26 mol 100 unq 0 iso 2 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 8.72704 10.1589 7.2495 15.9331 9.00544 14.9392 11.8512 9.01214 14.6145 numMergedOcc 0
27 mol 100 unq 0 iso 3 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 8.72704 10.1589 15.9331 7.2495 9.00544 14.9392 9.01214 11.8512 14.6145 numMergedOcc 0
28 mol 100 unq 0 iso 4 dist 8.86688 6.45675 9.71151 7.47343 10.1407 5.33144 8.72704 15.9331 7.2495 10.1589 9.00544 9.01214 11.8512 14.9392 14.6145 numMergedOcc 0
29 mol 100 unq 0 iso 5 dist 8.86688 7.47343 10.1407 6.45675 9.71151 5.33144 8.72704 15.9331 10.1589 7.2495 9.00544 9.01214 14.9392 11.8512 14.6145 numMergedOcc 0
30 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 7.12017 9.52882 12.6602 14.8674 6.00843 numMergedOcc 0
31 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 7.12017 9.52882 14.8674 12.6602 6.00843 numMergedOcc 0
32 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 7.12017 12.6602 9.52882 14.8674 6.00843 numMergedOcc 0
33 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 7.12017 12.6602 14.8674 9.52882 6.00843 numMergedOcc 0
34 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 7.12017 14.8674 9.52882 12.6602 6.00843 numMergedOcc 0
35 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 7.12017 14.8674 12.6602 9.52882 6.00843 numMergedOcc 0
36 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 5.72642 5.61704 6.4497 7.3094 5.87507 numMergedOcc 0
37 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 5.72642 5.61704 7.3094 6.4497 5.87507 numMergedOcc 0
38 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 5.72642 6.4497 5.61704 7.3094 5.87507 numMergedOcc 0
39 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 5.72642 6.4497 7.3094 5.61704 5.87507 numMergedOcc 0
40 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 5.72642 7.3094 5.61704 6.4497 5.87507 numMergedOcc 0
41 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 5.72642 7.3094 6.4497 5.61704 5.87507 numMergedOcc 0
42 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 9.17106 12.6057 8.38032 8.16815 5.14959 numMergedOcc 0
43 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 9.17106 12.6057 8.16815 8.38032 5.14959 numMergedOcc 0
44 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 9.17106 8.38032 12.6057 8.16815 5.14959 numMergedOcc 0
45 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 9.17106 8.38032 8.16815 12.6057 5.14959 numMergedOcc 0
46 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 9.17106 8.16815 12.6057 8.38032 5.14959 numMergedOcc 0
47 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 9.17106 8.16815 8.38032 12.6057 5.14959 numMergedOcc 0
48 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 7.73169 5.71107 11.2067 9.44399 14.0853 numMergedOcc 0
49 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 7.73169 5.71107 9.44399 11.2067 14.0853 numMergedOcc 0
50 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 7.73169 11.2067 5.71107 9.44399 14.0853 numMergedOcc 0
51 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 7.73169 11.2067 9.44399 5.71107 14.0853 numMergedOcc 0
52 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 7.73169 9.44399 5.71107 11.2067 14.0853 numMergedOcc 0
53 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 7.73169 9.44399 11.2067 5.71107 14.0853 numMergedOcc 0
54 mol 156 unq 1 iso 0 dist 8.34702 9.06726 6.31306 8.33171 6.56229 5.64555 7.36119 11.787 7.71144 9.22231 5.38091 10.7023 9.00862 11.1271 5.33988 numMergedOcc 0
55 mol 156 unq 1 iso 1 dist 8.34702 8.33171 6.56229 9.06726 6.31306 5.64555 7.36119 11.787 9.22231 7.71144 5.38091 10.7023 11.1271 9.00862 5.33988 numMergedOcc 0
56 mol 156 unq 1 iso 2 dist 9.06726 8.34702 6.31306 8.33171 5.64555 6.56229 7.36119 7.71144 11.787 9.22231 5.38091 9.00862 10.7023 11.1271 5.33988 numMergedOcc 0
57 mol 156 unq 1 iso 3 dist 9.06726 8.33171 5.64555 8.34702 6.31306 6.56229 7.36119 7.71144 9.22231 11.787 5.38091 9.00862 11.1271 10.7023 5.33988 numMergedOcc 0
58 mol 156 unq 1 iso 4 dist 8.33171 8.34702 6.56229 9.06726 5.64555 6.31306 7.36119 9.22231 11.787 7.71144 5.38091 11.1271 10.7023 9.00862 5.33988 numMergedOcc 0
59 mol 156 unq 1 iso 5 dist 8.33171 9.06726 5.64555 8.34702 6.56229 6.31306 7.36119 9.22231 7.71144 11.787 5.38091 11.1271 9.00862 10.7023 5.33988 numMergedOcc 0
60 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 4.92088 10.1489 8.27339 9.79302 7.07052 numMergedOcc 0
61 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 4.92088 10.1489 9.79302 8.27339 7.07052 numMergedOcc 0
62 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 4.92088 8.27339 10.1489 9.79302 7.07052 numMergedOcc 0
63 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 4.92088 8.27339 9.79302 10.1489 7.07052 numMergedOcc 0
64 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 4.92088 9.79302 10.1489 8.27339 7.07052 numMergedOcc 0
65 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 4.92088 9.79302 8.27339 10.1489 7.07052 numMergedOcc 0
66 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 4.92088 10.1489 8.27339 8.65097 7.07052 numMergedOcc 0
67 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 4.92088 10.1489 8.65097 8.27339 7.07052 numMergedOcc 0
68 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 4.92088 8.27339 10.1489 8.65097 7.07052 numMergedOcc 0
69 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 4.92088 8.27339 8.65097 10.1489 7.07052 numMergedOcc 0
70 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 4.92088 8.65097 10.1489 8.27339 7.07052 numMergedOcc 0
71 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 4.92088 8.65097 8.27339 10.1489 7.07052 numMergedOcc 0
72 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 4.92088 10.1489 9.79302 8.65097 7.07052 numMergedOcc 0
73 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 4.92088 10.1489 8.65097 9.79302 7.07052 numMergedOcc 0
74 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 4.92088 9.79302 10.1489 8.65097 7.07052 numMergedOcc 0
75 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 4.92088 9.79302 8.65097 10.1489 7.07052 numMergedOcc 0
76 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 4.92088 8.65097 10.1489 9.79302 7.07052 numMergedOcc 0
77 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 4.92088 8.65097 9.79302 10.1489 7.07052 numMergedOcc 0
78 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 4.92088 8.27339 9.79302 8.65097 7.07052 numMergedOcc 0
79 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 4.92088 8.27339 8.65097 9.79302 7.07052 numMergedOcc 0
80 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 4.92088 9.79302 8.27339 8.65097 7.07052 numMergedOcc 0
81 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 4.92088 9.79302 8.65097 8.27339 7.07052 numMergedOcc 0
82 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 4.92088 8.65097 8.27339 9.79302 7.07052 numMergedOcc 0
83 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 4.92088 8.65097 9.79302 8.27339 7.07052 numMergedOcc 0
84 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 6.51749 13.8722 5.93488 7.64267 10.4684 numMergedOcc 0
85 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 6.51749 13.8722 7.64267 5.93488 10.4684 numMergedOcc 0
86 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 6.51749 5.93488 13.8722 7.64267 10.4684 numMergedOcc 0
87 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 6.51749 5.93488 7.64267 13.8722 10.4684 numMergedOcc 0
88 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 6.51749 7.64267 13.8722 5.93488 10.4684 numMergedOcc 0
89 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 6.51749 7.64267 5.93488 13.8722 10.4684 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 6.51749 13.8722 5.93488 7.64267 12.69 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 6.51749 13.8722 7.64267 5.93488 12.69 numMergedOcc 0
92 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 6.51749 5.93488 13.8722 7.64267 12.69 numMergedOcc 0
93 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 6.51749 5.93488 7.64267 13.8722 12.69 numMergedOcc 0
94 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 6.51749 7.64267 13.8722 5.93488 12.69 numMergedOcc 0
95 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 6.51749 7.64267 5.93488 13.8722 12.69 numMergedOcc 0
96 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 6.38157 7.38025 9.35273 5.63388 9.26037 numMergedOcc 0
97 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 6.38157 7.38025 5.63388 9.35273 9.26037 numMergedOcc 0
98 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 6.38157 9.35273 7.38025 5.63388 9.26037 numMergedOcc 0
99 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 6.38157 9.35273 5.63388 7.38025 9.26037 numMergedOcc 0
100 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 6.38157 5.63388 7.38025 9.35273 9.26037 numMergedOcc 0
101 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 6.38157 5.63388 9.35273 7.38025 9.26037 numMergedOcc 0
102 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 6.38157 7.38025 9.35273 5.63388 11.353 numMergedOcc 0
103 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 6.38157 7.38025 5.63388 9.35273 11.353 numMergedOcc 0
104 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 6.38157 9.35273 7.38025 5.63388 11.353 numMergedOcc 0
105 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 6.38157 9.35273 5.63388 7.38025 11.353 numMergedOcc 0
106 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 6.38157 5.63388 7.38025 9.35273 11.353 numMergedOcc 0
107 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 6.38157 5.63388 9.35273 7.38025 11.353 numMergedOcc 0
108 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 8.24186 11.7705 5.63086 5.6819 13.0974 numMergedOcc 0
109 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 8.24186 11.7705 5.6819 5.63086 13.0974 numMergedOcc 0
110 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 8.24186 5.63086 11.7705 5.6819 13.0974 numMergedOcc 0
111 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 8.24186 5.63086 5.6819 11.7705 13.0974 numMergedOcc 0
112 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 8.24186 5.6819 11.7705 5.63086 13.0974 numMergedOcc 0
113 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 8.24186 5.6819 5.63086 11.7705 13.0974 numMergedOcc 0
114 mol 236 unq 0 iso 0 dist 9.81562 7.68742 5.79505 6.27581 9.90963 11.3368 5.34718 11.8759 11.3552 6.04825 8.50331 7.22918 9.05842 7.00028 11.6774 numMergedOcc 0
115 mol 236 unq 0 iso 1 dist 9.81562 6.27581 9.90963 7.68742 5.79505 11.3368 5.34718 11.8759 6.04825 11.3552 8.50331 7.22918 7.00028 9.05842 11.6774 numMergedOcc 0
116 mol 236 unq 0 iso 2 dist 7.68742 9.81562 5.79505 6.27581 11.3368 9.90963 5.34718 11.3552 11.8759 6.04825 8.50331 9.05842 7.22918 7.00028 11.6774 numMergedOcc 0
117 mol 236 unq 0 iso 3 dist 7.68742 6.27581 11.3368 9.81562 5.79505 9.90963 5.34718 11.3552 6.04825 11.8759 8.50331 9.05842 7.00028 7.22918 11.6774 numMergedOcc 0
118 mol 236 unq 0 iso 4 dist 6.27581 9.81562 9.90963 7.68742 11.3368 5.79505 5.34718 6.04825 11.8759 11.3552 8.50331 7.00028 7.22918 9.05842 11.6774 numMergedOcc 0
119 mol 236 unq 0 iso 5 dist 6.27581 7.68742 11.3368 9.81562 9.90963 5.79505 5.34718 6.04825 11.3552 11.8759 8.50331 7.00028 9.05842 7.22918 11.6774 numMergedOcc 0
