0 mol 25 unq 0 iso 0 dist 8.46842 10.5274 8.40051 5.85389 6.90155 13.0772 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.28058 7.70943 8.06168 11.8984 5.16364 9.33688 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 7.28058 3.98918 8.67532 11.8984 5.16364 13.4716 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.24378 11.8144 8.58841 7.63473 4.79949 5.25697 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 7.24378 11.8144 8.58841 5.23489 7.27693 10.7962 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 9.41521 9.0362 7.04864 13.1667 8.93905 4.63594 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 6.44766 11.2112 7.81337 13.6401 9.29384 6.99491 numMergedOcc 0
7 mol 180 unq 0 iso 0 dist 7.24785 16.5686 9.88732 9.54991 9.18528 12.4792 numMergedOcc 0
8 mol 180 unq 1 iso 0 dist 7.24785 11.9699 5.77949 9.54991 9.18528 8.4927 numMergedOcc 0
9 mol 180 unq 2 iso 0 dist 7.24785 14.8912 8.68403 9.54991 9.18528 11.4009 numMergedOcc 0
10 mol 180 unq 3 iso 0 dist 7.24785 4.80648 5.80441 9.54991 9.18528 5.05257 numMergedOcc 0
11 mol 180 unq 4 iso 0 dist 7.53287 15.4961 9.88732 7.78726 9.18528 12.4792 numMergedOcc 0
12 mol 180 unq 5 iso 0 dist 7.53287 10.2233 5.77949 7.78726 9.18528 8.4927 numMergedOcc 0
13 mol 180 unq 6 iso 0 dist 7.53287 12.1751 8.68403 7.78726 9.18528 11.4009 numMergedOcc 0
14 mol 180 unq 7 iso 0 dist 7.53287 5.28726 5.80441 7.78726 9.18528 5.05257 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.33638 16.7561 9.51764 13.6007 6.38157 10.5029 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 9.33638 5.24733 5.36829 13.6007 6.38157 8.38755 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 9.95084 15.8157 7.73315 8.06305 8.06216 9.58139 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 9.95084 15.8157 7.73315 12.0325 5.76954 5.77167 numMergedOcc 0
19 mol 218 unq 2 iso 0 dist 9.95084 15.8157 7.73315 9.24887 6.29511 13.9605 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 9.68636 12.8446 8.6537 7.82856 8.92743 7.78418 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 7.17987 14.3029 7.86368 14.2602 7.5366 6.83465 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 9.75753 12.1288 5.89502 14.9103 7.77998 5.73565 numMergedOcc 0
23 mol 253 unq 1 iso 0 dist 9.75753 15.7857 7.15815 14.9103 7.77998 9.82329 numMergedOcc 0
24 mol 257 unq 0 iso 0 dist 6.44188 9.11516 9.83721 7.39014 9.69696 11.6666 numMergedOcc 0
25 mol 257 unq 1 iso 0 dist 5.13633 12.611 9.83721 9.87316 9.69696 11.6666 numMergedOcc 0
26 mol 257 unq 2 iso 0 dist 6.50405 6.07988 7.82899 7.86233 9.95546 5.76954 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 9.89728 18.6806 9.54857 9.80192 8.55558 12.7168 numMergedOcc 0
28 mol 264 unq 0 iso 0 dist 6.66602 9.34577 6.83408 7.02897 6.42588 5.7394 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 5.22392 11.3025 9.77689 10.6266 6.57903 9.41779 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 5.22392 4.1574 8.51931 10.6266 6.57903 12.4389 numMergedOcc 0
