0 mol 34 unq 0 iso 0 dist 7.59353 12.0763 9.33027 4.36931 9.26362 9.87332 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 7.59353 12.0763 9.33027 7.30954 7.05327 6.35031 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 7.59353 6.56069 7.32707 4.36931 9.26362 3.9873 numMergedOcc 0
3 mol 34 unq 3 iso 0 dist 7.59353 6.56069 7.32707 7.30954 7.05327 5.50427 numMergedOcc 0
4 mol 34 unq 4 iso 0 dist 7.59353 4.50413 7.90574 4.36931 9.26362 4.5357 numMergedOcc 0
5 mol 34 unq 5 iso 0 dist 7.59353 4.50413 7.90574 7.30954 7.05327 3.54863 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 8.79724 10.2993 9.56752 11.6646 6.18681 5.57394 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 8.79724 10.2993 9.56752 11.9169 9.33288 3.54647 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.55666 14.8432 7.33541 8.60758 5.45882 11.746 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 8.55666 14.8432 7.33541 7.49297 4.57487 9.9322 numMergedOcc 0
10 mol 113 unq 2 iso 0 dist 8.45284 14.8242 7.33541 5.85846 5.45882 11.746 numMergedOcc 0
11 mol 113 unq 3 iso 0 dist 8.45284 14.8242 7.33541 5.23629 4.57487 9.9322 numMergedOcc 0
12 mol 113 unq 4 iso 0 dist 7.77845 4.81689 7.33541 10.3632 5.45882 11.746 numMergedOcc 0
13 mol 113 unq 5 iso 0 dist 7.77845 4.81689 7.33541 9.86085 4.57487 9.9322 numMergedOcc 0
14 mol 113 unq 6 iso 0 dist 9.43828 9.30445 7.33541 14.0625 5.45882 11.746 numMergedOcc 0
15 mol 113 unq 7 iso 0 dist 9.43828 9.30445 7.33541 11.2311 4.57487 9.9322 numMergedOcc 0
16 mol 114 unq 0 iso 0 dist 7.90329 7.46008 6.13559 6.06647 8.61909 3.67473 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 8.82363 8.23469 5.52683 10.39 6.40751 3.84623 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 5.76702 5.6686 5.52683 8.89934 6.40751 3.84623 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.73021 6.61098 7.02079 11.3904 8.08777 5.88357 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 9.73021 14.0657 5.88802 11.3904 8.08777 9.24057 numMergedOcc 0
21 mol 239 unq 2 iso 0 dist 6.2537 13.1054 9.01462 14.4548 9.99181 7.18773 numMergedOcc 0
22 mol 239 unq 3 iso 0 dist 8.47364 15.0382 7.02079 13.3114 8.08777 5.88357 numMergedOcc 0
23 mol 239 unq 4 iso 0 dist 8.47364 4.50161 5.88802 13.3114 8.08777 9.24057 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 9.19369 13.5186 8.71497 9.98034 9.28024 9.75001 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 6.61098 10.7379 7.34094 11.3526 8.56867 13.0664 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 6.61098 10.7379 7.34094 8.93485 6.29872 10.4666 numMergedOcc 0
27 mol 264 unq 2 iso 0 dist 6.25794 10.3005 7.34094 6.26054 8.56867 13.0664 numMergedOcc 0
28 mol 264 unq 3 iso 0 dist 6.25794 10.3005 7.34094 3.81537 6.29872 10.4666 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 9.99897 5.63261 5.59555 5.6513 7.77225 3.96271 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 9.99897 5.63261 5.59555 9.53574 5.50067 5.39801 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 9.99897 5.63261 5.59555 5.6513 7.77225 3.96271 numMergedOcc 0
32 mol 288 unq 1 iso 0 dist 9.99897 5.63261 5.59555 9.53574 5.50067 5.39801 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 9.99897 5.63261 5.59555 5.6513 7.77225 3.96271 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 9.99897 5.63261 5.59555 9.53574 5.50067 5.39801 numMergedOcc 0
