0 mol 7 unq 0 iso 0 dist 7.11539 9.17482 8.72114 15.9303 13.8829 7.10621 18.4407 13.6379 10.789 7.31201 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.11539 9.17482 8.72114 15.9303 13.8829 7.10621 15.5773 9.97624 10.515 9.36807 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 8.3794 9.85033 7.48342 12.0227 4.39605 8.38064 13.7983 10.0974 5.90976 8.21493 numMergedOcc 0
3 mol 15 unq 1 iso 0 dist 8.3794 9.85033 7.48342 18.6406 12.1303 9.97507 13.7983 10.0974 5.90976 7.12903 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.99176 7.11047 6.85556 9.90392 5.68392 6.03987 11.2386 9.71382 10.3635 7.685 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 6.98583 10.7715 6.85556 10.9818 5.68392 6.03987 9.66509 9.71382 10.3635 7.685 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 5.94373 7.26966 9.97159 8.75668 6.21578 9.67592 4.97497 9.32552 5.3948 8.68586 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 7.89317 8.82375 9.23858 13.0414 9.89358 8.73993 13.5328 15.8603 10.6679 9.63176 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.809 10.6249 9.90168 13.4587 8.23791 7.12972 9.73933 11.4282 6.19596 8.6243 numMergedOcc 0
9 mol 131 unq 1 iso 0 dist 8.809 10.6249 9.90168 15.5814 13.7237 6.85062 9.73933 11.4282 6.19596 6.91348 numMergedOcc 0
10 mol 131 unq 2 iso 0 dist 8.809 10.6249 9.90168 15.5814 13.7237 6.85062 15.2269 16.3398 6.6499 9.51418 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.2933 5.32364 5.9176 11.9989 5.63555 7.63312 14.0045 5.97685 9.60512 7.98142 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 9.2933 5.32364 5.9176 11.9989 5.63555 7.63312 17.8726 8.9289 13.3389 7.37327 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 7.08557 5.38569 5.94469 12.5003 7.77758 7.81386 10.2555 7.05653 6.7991 4.93785 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 7.08557 5.38569 5.94469 12.5213 12.5387 7.63312 6.93325 10.6207 4.80231 6.93764 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 8.77781 13.9725 9.39829 11.9989 7.20191 7.81386 14.0045 13.5221 9.53462 7.98142 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 8.77781 13.9725 9.39829 11.9989 7.20191 7.81386 17.8726 14.5372 11.1462 7.37327 numMergedOcc 0
17 mol 181 unq 6 iso 0 dist 8.77781 5.32364 6.41453 11.9989 7.20191 7.63312 14.0045 13.5221 9.60512 7.98142 numMergedOcc 0
18 mol 181 unq 7 iso 0 dist 8.77781 5.32364 6.41453 11.9989 7.20191 7.63312 17.8726 14.5372 13.3389 7.37327 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 7.59757 10.2677 7.32294 9.44947 5.86489 8.51516 12.7783 11.641 12.9483 5.90931 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 8.64079 7.61997 6.85935 13.2724 6.552 7.56373 13.5694 12.3767 6.43758 9.52027 numMergedOcc 0
21 mol 209 unq 1 iso 0 dist 8.76128 8.42394 6.85935 9.62543 6.552 7.56373 12.5973 12.3767 6.43758 9.52027 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 4.54224 6.29733 6.59716 10.2501 7.11498 9.23153 10.3117 9.7334 6.7067 6.84247 numMergedOcc 0
23 mol 220 unq 1 iso 0 dist 4.54224 6.29733 6.59716 10.2501 7.11498 9.23153 16.4532 13.5801 15.9568 6.99002 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 8.99878 5.54495 9.01021 6.43546 10.0842 7.00034 10.9732 10.9156 7.04058 7.20082 numMergedOcc 0
