0 mol 16 unq 0 iso 0 dist 8.17898 9.04834 10.2656 12.0005 7.03948 16.3417 5.37568 6.42835 7.65889 9.87867 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.87176 7.45675 10.2272 11.9261 7.96497 17.2527 11.3486 15.2196 6.17207 22.4828 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 4.24428 6.30194 5.7113 5.14919 5.64598 4.65521 10.7557 11.6739 8.68662 6.10063 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 4.24428 6.30194 5.7113 5.14919 5.64598 4.65521 11.1632 10.9476 7.4369 6.15714 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 9.56867 7.44784 11.5723 7.97477 6.99777 11.695 6.3642 11.8378 6.04595 13.2709 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 9.56867 7.44784 11.5723 6.58038 9.14376 10.0603 6.3642 11.8378 6.04595 5.53947 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 6.2403 8.34869 4.35917 6.58856 6.03703 7.61505 11.6543 6.89918 7.89457 6.545 numMergedOcc 0
7 mol 132 unq 1 iso 0 dist 8.34869 6.2403 4.35917 6.58856 7.61505 6.03703 11.6543 7.89457 6.89918 6.545 numMergedOcc 0
8 mol 132 unq 2 iso 0 dist 6.495 9.43748 4.35917 10.343 6.03703 7.61505 7.05332 6.89918 7.89457 6.545 numMergedOcc 0
9 mol 132 unq 3 iso 0 dist 9.43748 6.495 4.35917 10.343 7.61505 6.03703 7.05332 7.89457 6.89918 6.545 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 7.97208 5.67862 5.00817 6.30187 8.6355 5.42582 7.77359 9.55584 9.33924 6.0991 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 7.97208 5.67862 5.00817 6.30187 8.6355 5.42582 10.8891 11.988 7.93372 5.67107 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 7.7292 6.27396 12.5143 11.695 5.90931 16.9866 5.22975 12.7968 5.94972 16.6265 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 8.09769 7.24832 7.02195 7.42613 4.87541 10.105 4.74338 4.33238 7.83604 3.78261 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 9.97357 6.36941 7.28249 11.4732 7.17676 5.34718 5.3331 10.1317 9.3206 13.0765 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 9.97357 6.36941 7.28249 14.1057 6.68463 10.5713 5.3331 10.1317 9.3206 12.5813 numMergedOcc 0
16 mol 284 unq 0 iso 0 dist 8.08993 7.34344 13.5089 9.65436 8.41504 14.711 12.1528 18.4692 5.83329 17.5719 numMergedOcc 0
