0 mol 1 unq 0 iso 0 dist 5.65716 6.44928 6.09918 9.44115 8.78328 8.56884 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.93613 11.7623 9.78006 9.79973 7.98363 6.85412 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.93613 11.7623 9.78006 6.95341 10.4204 6.33889 numMergedOcc 0
3 mol 20 unq 0 iso 0 dist 9.47968 12.6153 8.72023 14.5111 6.31611 6.4934 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.97432 6.17631 5.81959 13.4756 9.96732 7.685 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 6.73259 4.09495 5.69955 8.62693 4.80984 9.16962 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.60352 8.26353 5.69955 13.0944 4.80984 9.16962 numMergedOcc 0
7 mol 26 unq 2 iso 0 dist 9.46609 13.1626 8.44506 14.7696 8.13684 6.73162 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 6.15568 4.18584 6.06454 9.61766 5.94047 7.06308 numMergedOcc 0
9 mol 45 unq 1 iso 0 dist 6.15568 9.0702 9.44459 9.61766 5.94047 6.34173 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 9.28282 4.57694 4.79949 12.7988 6.81799 8.97793 numMergedOcc 0
11 mol 76 unq 1 iso 0 dist 9.28282 4.57694 4.79949 10.8071 8.83525 8.19682 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 5.82501 7.6321 9.7918 9.78437 7.27945 6.96442 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 5.33314 11.4573 8.71039 11.9701 8.15392 8.6243 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 8.4673 4.27736 5.4969 12.4545 11.4433 9.52634 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 9.12296 4.27736 7.35824 12.4545 6.05776 9.52634 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 7.52171 6.8278 6.47873 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 7.47107 7.72655 8.83356 6.289 7.69247 5.48258 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 7.47107 7.72655 8.83356 9.99555 13.9521 6.15769 numMergedOcc 0
19 mol 194 unq 3 iso 0 dist 7.47107 4.57265 8.2654 7.52171 6.8278 8.38695 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 9.6309 10.8948 6.29511 18.472 10.1198 8.53199 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 8.12518 12.3465 8.38865 11.6985 5.92529 8.17891 numMergedOcc 0
22 mol 227 unq 1 iso 0 dist 8.12518 7.2593 5.4694 8.42382 5.23507 9.62609 numMergedOcc 0
23 mol 227 unq 2 iso 0 dist 8.12518 7.2593 5.4694 11.6985 5.92529 6.95902 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 8.38439 4.15973 8.50331 6.98151 11.6774 5.34718 numMergedOcc 0
25 mol 240 unq 0 iso 0 dist 8.44671 15.9853 9.47583 16.9462 9.75032 6.15305 numMergedOcc 0
26 mol 240 unq 1 iso 0 dist 8.44671 15.9853 9.47583 20.5465 12.9871 8.0951 numMergedOcc 0
27 mol 240 unq 2 iso 0 dist 8.44671 13.1893 8.44909 16.9462 9.75032 7.03489 numMergedOcc 0
28 mol 272 unq 0 iso 0 dist 8.60979 9.38679 9.19033 10.8037 11.8912 9.09992 numMergedOcc 0
29 mol 272 unq 1 iso 0 dist 8.60979 9.38679 9.19033 11.86 6.56154 6.16449 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 6.63662 4.37547 7.4099 10.8 12.6784 6.50589 numMergedOcc 0
