0 mol 0 unq 0 iso 0 dist 8.99617 11.2001 9.19007 14.0721 9.64573 7.65806 18.0627 14.0232 6.91778 9.15528 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 7.21619 8.75206 8.80762 11.0133 12.3097 8.41585 13.4942 10.0658 5.99972 12.0193 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.41365 13.4414 6.92532 19.8554 12.3486 7.20519 20.0127 13.9675 7.75618 4.96411 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.41365 13.4414 6.92532 13.1233 5.18512 4.54938 20.0127 13.9675 7.75618 9.74255 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 8.41365 13.4414 6.92532 15.2251 9.47529 6.864 20.0127 13.9675 7.75618 7.08342 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 5.78238 9.59761 6.60423 10.6042 6.00575 6.86014 16.7308 11.9395 9.41441 6.66749 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 5.78238 9.59761 6.60423 9.90845 5.97304 8.86116 16.7308 11.9395 9.41441 14.012 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.95491 11.9657 6.49956 14.7733 6.86728 9.33898 12.1543 12.0757 8.91313 17.5889 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 8.95491 11.9657 6.49956 14.7733 6.86728 9.33898 14.7793 7.64508 8.16392 10.8304 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 8.95491 11.9657 6.49956 19.5554 12.163 9.64443 12.1543 12.0757 8.91313 13.3881 numMergedOcc 0
10 mol 92 unq 3 iso 0 dist 8.95491 11.9657 6.49956 19.5554 12.163 9.64443 14.7793 7.64508 8.16392 5.90097 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 9.07229 10.6381 8.41611 13.7165 12.7056 5.99315 18.178 15.0801 7.78652 6.48978 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 9.07229 10.6381 8.41611 13.7165 12.7056 5.99315 18.2773 15.0315 8.91301 5.20762 numMergedOcc 0
13 mol 143 unq 2 iso 0 dist 8.98581 4.98373 7.63338 9.73212 12.8872 5.99315 10.8751 11.5146 7.78652 6.48978 numMergedOcc 0
14 mol 143 unq 3 iso 0 dist 8.98581 4.98373 7.63338 9.73212 12.8872 5.99315 13.1013 13.434 8.91301 5.20762 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 8.86912 7.46358 5.38091 14.041 10.7023 8.34702 12.2197 12.4049 7.30357 10.4977 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 8.86912 7.46358 5.38091 14.041 10.7023 8.34702 14.829 11.7015 8.61587 12.4274 numMergedOcc 0
17 mol 156 unq 2 iso 0 dist 8.86912 7.46358 5.38091 15.9053 9.00862 9.06726 12.2197 12.4049 7.30357 12.3086 numMergedOcc 0
18 mol 156 unq 3 iso 0 dist 8.86912 7.46358 5.38091 15.9053 9.00862 9.06726 14.829 11.7015 8.61587 10.9151 numMergedOcc 0
19 mol 156 unq 4 iso 0 dist 8.86912 7.46358 5.38091 15.6718 11.1271 8.33171 12.2197 12.4049 7.30357 7.79535 numMergedOcc 0
20 mol 156 unq 5 iso 0 dist 8.86912 7.46358 5.38091 15.6718 11.1271 8.33171 14.829 11.7015 8.61587 6.98125 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 9.51006 10.568 7.20574 16.7935 8.90184 7.54065 13.6647 11.8992 8.73217 11.7429 numMergedOcc 0
22 mol 223 unq 0 iso 0 dist 6.82737 4.67731 6.13306 12.0111 6.52273 8.77153 6.64193 6.80048 7.48463 11.8654 numMergedOcc 0
23 mol 223 unq 1 iso 0 dist 6.82737 4.67731 6.13306 10.6785 7.12885 8.6166 6.64193 6.80048 7.48463 6.05524 numMergedOcc 0
24 mol 223 unq 2 iso 0 dist 6.80967 7.19485 6.13306 9.5211 6.52273 8.77153 11.867 6.80048 7.48463 11.8654 numMergedOcc 0
25 mol 223 unq 3 iso 0 dist 6.80967 7.19485 6.13306 13.3416 7.12885 8.6166 11.867 6.80048 7.48463 6.05524 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 6.29118 4.90814 7.83711 11.2186 8.25884 8.27212 13.5442 13.8622 9.05071 8.80479 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 4.7359 4.74041 8.24186 10.6962 11.7705 8.34494 10.2618 9.68666 9.81425 4.3717 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 4.7359 4.74041 8.24186 5.89084 5.63086 6.56247 10.2618 9.68666 9.81425 4.46561 numMergedOcc 0
29 mol 234 unq 2 iso 0 dist 4.7359 4.74041 8.24186 8.47009 5.6819 9.36357 10.2618 9.68666 9.81425 10.641 numMergedOcc 0
