0 mol 25 unq 0 iso 0 dist 8.46842 16.8735 9.48085 17.4161 10.9391 9.49421 19.9296 12.1492 8.53931 4.70708 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 7.09258 7.54321 6.21799 13.6285 7.04035 9.74228 10.2171 6.11922 9.14817 6.00418 numMergedOcc 0
2 mol 72 unq 1 iso 0 dist 7.09258 7.54321 6.21799 13.592 8.24309 7.12321 10.2171 6.11922 9.14817 9.0131 numMergedOcc 0
3 mol 72 unq 2 iso 0 dist 7.09258 5.2819 5.03251 12.0429 5.8486 9.56773 10.2171 6.11922 9.76686 9.93049 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 8.40871 10.8182 6.85523 15.4151 7.19663 8.65848 11.4506 4.92509 5.47706 5.22036 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 9.48388 4.54306 7.78931 10.5303 14.591 9.64383 7.00373 11.2452 4.44979 12.0058 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 9.48388 4.54306 7.78931 11.233 5.02887 7.54889 7.00373 11.2452 4.44979 10.0962 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 9.48388 10.9661 8.7497 12.9741 10.2427 5.10496 7.00373 11.2452 6.61111 8.70415 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 9.48388 10.9661 8.7497 15.2644 13.9786 5.92242 7.00373 11.2452 6.61111 9.74284 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 9.48388 10.9661 8.7497 11.233 5.02887 5.2571 7.00373 11.2452 6.61111 10.0962 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 7.31419 6.4405 5.35237 12.4741 6.90348 7.99477 12.9061 8.96357 6.57379 5.9915 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 7.31419 3.64555 8.70621 9.92467 13.7309 6.42772 8.72056 10.9715 6.44575 5.31077 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 7.31419 3.64555 8.70621 9.11672 7.09823 9.1998 8.72056 10.9715 6.44575 6.74887 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 7.18765 4.26432 9.10817 7.41091 5.43601 6.86828 9.47487 5.2908 9.27218 6.23998 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 7.41091 4.26432 6.86828 7.18765 5.43601 9.10817 9.47487 6.23998 9.27218 5.2908 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 9.30186 6.38826 8.1945 12.2976 13.3965 6.50998 14.7336 10.7506 8.91356 8.69249 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 9.30186 6.38826 8.1945 12.2976 13.3965 6.50998 8.23463 7.12954 9.59574 14.2819 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 7.17987 12.4759 7.81215 12.6184 10.2693 5.64285 5.99388 5.56749 9.11572 8.0608 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 7.17987 12.4759 7.81215 12.6184 10.2693 5.64285 15.9147 15.015 9.49229 5.34613 numMergedOcc 0
19 mol 234 unq 2 iso 0 dist 7.17987 12.4759 7.81215 12.6184 10.2693 5.64285 12.7447 12.1076 7.20293 6.29366 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.09166 17.7087 9.08509 17.3543 10.1813 6.99888 12.9754 5.17471 5.43613 5.54325 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 9.09166 17.7087 9.08509 17.3543 10.1813 6.99888 13.7959 5.03393 7.06768 10.0613 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.89728 13.7396 5.85442 14.0886 9.98105 6.9899 9.19369 5.79468 6.23661 5.31048 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 7.29148 14.9639 9.9182 15.3813 10.3106 7.30758 16.5375 9.98079 9.08193 5.07048 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 7.29148 14.9639 9.9182 15.3813 10.3106 7.30758 23.6788 18.0293 8.73515 12.1551 numMergedOcc 0
25 mol 292 unq 2 iso 0 dist 7.29148 14.9639 9.9182 18.975 12.1693 9.10788 16.5375 9.98079 9.08193 10.0311 numMergedOcc 0
26 mol 292 unq 3 iso 0 dist 7.29148 14.9639 9.9182 18.975 12.1693 9.10788 23.6788 18.0293 8.73515 10.8709 numMergedOcc 0
27 mol 292 unq 4 iso 0 dist 8.54692 9.47804 7.30758 15.4675 10.3106 9.9182 13.4639 5.07048 9.08193 9.98079 numMergedOcc 0
28 mol 292 unq 5 iso 0 dist 8.54692 9.47804 7.30758 15.4675 10.3106 9.9182 13.0711 12.1551 8.73515 18.0293 numMergedOcc 0
29 mol 292 unq 6 iso 0 dist 8.54692 9.47804 7.30758 18.1401 12.6861 9.10788 13.4639 5.07048 9.08193 10.0311 numMergedOcc 0
30 mol 292 unq 7 iso 0 dist 8.54692 9.47804 7.30758 18.1401 12.6861 9.10788 13.0711 12.1551 8.73515 10.8709 numMergedOcc 0
