0 mol 24 unq 0 iso 0 dist 6.72502 11.2106 9.40479 5.11636 8.24948 9.57743 8.60554 6.99746 4.90592 5.80953 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.72502 5.97304 9.38831 5.11636 8.24948 4.47891 8.60554 6.99746 9.36461 5.80953 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 9.81831 11.6865 5.51624 16.1023 7.8435 4.97727 24.4789 15.8624 12.9895 9.19977 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 9.81831 11.6865 5.51624 16.1023 7.8435 4.97727 23.3751 14.7862 11.9258 7.28831 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 9.81831 11.6865 5.51624 16.1023 7.8435 4.97727 18.2573 9.42916 10.6771 9.71411 numMergedOcc 0
5 mol 93 unq 3 iso 0 dist 9.81831 12.2598 7.8674 16.1023 7.8435 13.8087 24.4789 15.8624 21.5481 9.19977 numMergedOcc 0
6 mol 93 unq 4 iso 0 dist 9.81831 12.2598 7.8674 16.1023 7.8435 13.8087 23.3751 14.7862 19.7572 7.28831 numMergedOcc 0
7 mol 93 unq 5 iso 0 dist 9.81831 12.2598 7.8674 16.1023 7.8435 13.8087 18.2573 9.42916 14.1075 9.71411 numMergedOcc 0
8 mol 93 unq 6 iso 0 dist 9.12858 7.64463 5.51624 12.4934 7.8435 4.97727 20.2792 15.8624 12.9895 9.19977 numMergedOcc 0
9 mol 93 unq 7 iso 0 dist 9.12858 7.64463 5.51624 12.4934 7.8435 4.97727 19.3357 14.7862 11.9258 7.28831 numMergedOcc 0
10 mol 93 unq 8 iso 0 dist 9.12858 7.64463 5.51624 12.4934 7.8435 4.97727 16.6164 9.42916 10.6771 9.71411 numMergedOcc 0
11 mol 93 unq 9 iso 0 dist 9.12858 14.8533 7.8674 12.4934 7.8435 13.8087 20.2792 15.8624 21.5481 9.19977 numMergedOcc 0
12 mol 93 unq 10 iso 0 dist 9.12858 14.8533 7.8674 12.4934 7.8435 13.8087 19.3357 14.7862 19.7572 7.28831 numMergedOcc 0
13 mol 93 unq 11 iso 0 dist 9.12858 14.8533 7.8674 12.4934 7.8435 13.8087 16.6164 9.42916 14.1075 9.71411 numMergedOcc 0
14 mol 93 unq 12 iso 0 dist 9.4523 8.29171 5.51624 10.8106 7.8435 4.97727 19.7304 15.8624 12.9895 9.19977 numMergedOcc 0
15 mol 93 unq 13 iso 0 dist 9.4523 8.29171 5.51624 10.8106 7.8435 4.97727 17.211 14.7862 11.9258 7.28831 numMergedOcc 0
16 mol 93 unq 14 iso 0 dist 9.4523 8.29171 5.51624 10.8106 7.8435 4.97727 17.9577 9.42916 10.6771 9.71411 numMergedOcc 0
17 mol 93 unq 15 iso 0 dist 9.4523 12.7936 7.8674 10.8106 7.8435 13.8087 19.7304 15.8624 21.5481 9.19977 numMergedOcc 0
18 mol 93 unq 16 iso 0 dist 9.4523 12.7936 7.8674 10.8106 7.8435 13.8087 17.211 14.7862 19.7572 7.28831 numMergedOcc 0
19 mol 93 unq 17 iso 0 dist 9.4523 12.7936 7.8674 10.8106 7.8435 13.8087 17.9577 9.42916 14.1075 9.71411 numMergedOcc 0
20 mol 119 unq 0 iso 0 dist 7.77116 4.91132 8.03035 9.68677 9.57341 6.29394 17.8739 14.8901 14.7366 8.67537 numMergedOcc 0
21 mol 119 unq 1 iso 0 dist 7.77116 6.08167 7.6968 9.68677 9.57341 9.64502 17.8739 14.8901 15.9094 8.67537 numMergedOcc 0
22 mol 131 unq 0 iso 0 dist 9.15431 7.21005 7.76594 4.57579 6.78801 4.24991 10.8571 5.66194 5.39061 7.75314 numMergedOcc 0
23 mol 131 unq 1 iso 0 dist 6.92648 11.5688 7.76594 8.57203 6.78801 4.24991 11.8964 5.66194 5.39061 7.75314 numMergedOcc 0
24 mol 131 unq 2 iso 0 dist 9.29384 15.7796 7.76594 12.6005 6.78801 4.24991 14.9021 5.66194 5.39061 7.75314 numMergedOcc 0
25 mol 141 unq 0 iso 0 dist 6.69515 9.76015 8.26172 13.2918 6.77921 10.2834 11.0743 5.38571 11.5185 6.65731 numMergedOcc 0
26 mol 141 unq 1 iso 0 dist 7.86572 8.24418 8.26172 13.4066 6.77921 10.2834 9.97343 5.38571 11.5185 6.65731 numMergedOcc 0
27 mol 171 unq 0 iso 0 dist 9.11712 8.26419 9.75627 4.00127 8.999 6.1593 11.4288 11.6944 8.1536 7.47964 numMergedOcc 0
28 mol 194 unq 0 iso 0 dist 6.26839 6.66155 5.52678 10.0756 5.53324 5.28603 8.65535 5.92931 6.37788 4.19371 numMergedOcc 0
29 mol 194 unq 1 iso 0 dist 6.26839 6.66155 5.52678 11.8031 6.72182 9.8803 12.4952 7.50057 12.6186 9.00322 numMergedOcc 0
30 mol 194 unq 2 iso 0 dist 6.26839 5.4499 9.81666 10.0756 5.53324 11.0713 8.65535 5.92931 8.7028 4.19371 numMergedOcc 0
31 mol 194 unq 3 iso 0 dist 6.26839 5.4499 9.81666 11.8031 6.72182 15.9964 12.4952 7.50057 15.8032 9.00322 numMergedOcc 0
32 mol 194 unq 4 iso 0 dist 8.12346 6.12973 5.52678 10.2793 5.53324 5.28603 12.0009 5.92931 6.37788 4.19371 numMergedOcc 0
33 mol 194 unq 5 iso 0 dist 8.12346 6.12973 5.52678 9.09233 6.72182 9.8803 15.1649 7.50057 12.6186 9.00322 numMergedOcc 0
34 mol 194 unq 6 iso 0 dist 8.12346 11.0239 9.81666 10.2793 5.53324 11.0713 12.0009 5.92931 8.7028 4.19371 numMergedOcc 0
35 mol 194 unq 7 iso 0 dist 8.12346 11.0239 9.81666 9.09233 6.72182 15.9964 15.1649 7.50057 15.8032 9.00322 numMergedOcc 0
36 mol 194 unq 8 iso 0 dist 8.83356 13.0333 5.52678 10.463 5.53324 5.28603 12.645 5.92931 6.37788 4.19371 numMergedOcc 0
37 mol 194 unq 9 iso 0 dist 8.83356 13.0333 5.52678 4.66791 6.72182 9.8803 6.72379 7.50057 12.6186 9.00322 numMergedOcc 0
38 mol 194 unq 10 iso 0 dist 8.83356 18.6469 9.81666 10.463 5.53324 11.0713 12.645 5.92931 8.7028 4.19371 numMergedOcc 0
39 mol 194 unq 11 iso 0 dist 8.83356 18.6469 9.81666 4.66791 6.72182 15.9964 6.72379 7.50057 15.8032 9.00322 numMergedOcc 0
40 mol 194 unq 12 iso 0 dist 8.2654 10.1796 5.52678 12.8494 5.53324 5.28603 13.9101 5.92931 6.37788 4.19371 numMergedOcc 0
41 mol 194 unq 13 iso 0 dist 8.2654 10.1796 5.52678 7.73551 6.72182 9.8803 13.2138 7.50057 12.6186 9.00322 numMergedOcc 0
42 mol 194 unq 14 iso 0 dist 8.2654 13.5457 9.81666 12.8494 5.53324 11.0713 13.9101 5.92931 8.7028 4.19371 numMergedOcc 0
43 mol 194 unq 15 iso 0 dist 8.2654 13.5457 9.81666 7.73551 6.72182 15.9964 13.2138 7.50057 15.8032 9.00322 numMergedOcc 0
44 mol 225 unq 0 iso 0 dist 8.87609 11.5135 6.53728 3.97158 7.8744 11.6976 10.8091 8.98957 13.131 6.94762 numMergedOcc 0
45 mol 225 unq 1 iso 0 dist 8.87609 11.5135 6.53728 3.97158 7.8744 11.6976 10.281 6.59663 8.20162 7.7086 numMergedOcc 0
46 mol 227 unq 0 iso 0 dist 8.03442 11.0628 9.56257 5.0317 9.43618 7.3164 7.43071 12.8075 14.3567 9.18728 numMergedOcc 0
47 mol 227 unq 1 iso 0 dist 8.03442 11.0628 9.56257 5.0317 9.43618 7.3164 5.41321 4.59123 12.135 8.91971 numMergedOcc 0
48 mol 252 unq 0 iso 0 dist 6.53679 6.28227 8.55481 5.6214 5.9974 4.34126 12.9597 12.0545 7.39391 8.09509 numMergedOcc 0
49 mol 252 unq 1 iso 0 dist 7.50201 5.25252 8.55481 7.40852 5.9974 4.34126 11.0831 12.0545 7.39391 8.09509 numMergedOcc 0
