0 mol 73 unq 0 iso 0 dist 7.37476 6.28936 5.92936 4.50556 9.47045 9.95663 10.8557 11.7643 12.762 8.07498 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 7.37476 6.28936 5.92936 4.53367 8.68218 6.87319 10.8557 11.7643 12.762 7.46419 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.52544 6.1691 7.02854 4.77004 5.73235 5.22567 8.08674 10.0928 12.4201 7.48127 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 6.17633 9.59882 9.71692 8.47619 9.18753 11.8278 14.398 10.8037 16.0883 8.6953 numMergedOcc 0
4 mol 148 unq 1 iso 0 dist 9.32264 9.435 9.71692 12.407 9.18753 11.8278 18.5989 10.8037 16.0883 8.6953 numMergedOcc 0
5 mol 150 unq 0 iso 0 dist 6.20295 9.57563 9.73708 8.33704 9.15244 11.6537 14.3514 10.8647 16.0617 8.65967 numMergedOcc 0
6 mol 150 unq 1 iso 0 dist 9.34249 9.39127 9.73708 12.3632 9.15244 11.6537 18.628 10.8647 16.0617 8.65967 numMergedOcc 0
7 mol 189 unq 0 iso 0 dist 8.51507 4.92782 5.11059 6.00118 9.95686 4.92169 11.6023 8.91303 7.04604 7.54658 numMergedOcc 0
8 mol 189 unq 1 iso 0 dist 8.51507 4.92782 5.11059 5.48787 9.47321 8.03657 10.5148 8.74557 10.0857 6.38294 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.64006 16.6231 7.86207 4.47683 8.57174 14.3078 10.2603 12.1405 14.4096 6.80214 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 8.4319 6.72716 9.59937 10.3585 7.58554 5.94643 12.3416 7.99748 10.2589 8.26312 numMergedOcc 0
11 mol 245 unq 0 iso 0 dist 5.70624 4.84566 7.26913 12.1537 7.95061 11.8346 20.1287 15.2703 20.9689 9.5096 numMergedOcc 0
12 mol 245 unq 1 iso 0 dist 5.70624 11.4898 6.41862 12.1537 7.95061 3.53109 20.1287 15.2703 10.8718 9.5096 numMergedOcc 0
13 mol 245 unq 2 iso 0 dist 5.70624 13.484 8.69377 12.1537 7.95061 9.71014 20.1287 15.2703 15.1895 9.5096 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.27225 4.49451 8.97411 11.1283 8.58092 13.2474 16.1106 8.76629 16.4669 7.53199 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 9.27225 4.49451 8.97411 11.1283 8.58092 13.2474 12.0657 5.64447 11.4777 7.40014 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 8.78501 12.4808 8.12204 8.96584 9.39714 5.91091 13.7111 13.1611 6.58277 6.57444 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 9.60879 9.93994 6.23539 4.00063 6.66936 5.95045 6.92271 11.3688 12.4458 8.15119 numMergedOcc 0
