0 mol 32 unq 0 iso 0 dist 7.12013 9.46895 8.79217 6.19304 8.43877 12.7517 13.7123 15.2557 7.13608 16.2251 numMergedOcc 0
1 mol 71 unq 0 iso 0 dist 4.87423 7.12853 5.01302 8.72533 10.1334 6.64442 3.843 4.76283 6.14513 9.14345 numMergedOcc 0
2 mol 71 unq 1 iso 0 dist 4.76283 6.14513 5.01302 9.14345 10.1334 6.64442 3.843 4.87423 7.12853 8.72533 numMergedOcc 0
3 mol 71 unq 2 iso 0 dist 7.75237 7.12853 9.08204 8.72533 8.8528 6.64442 3.843 10.8022 6.14513 9.14345 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.87856 6.62952 11.2334 6.04768 11.3708 12.2431 5.4823 11.3126 4.3521 9.40173 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 6.2491 6.62952 7.89992 6.04768 7.43547 12.2431 5.4823 3.59451 4.3521 9.40173 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 3.59451 4.3521 7.89992 9.40173 7.43547 12.2431 5.4823 6.2491 6.62952 6.04768 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 6.47989 5.50879 4.68339 8.32841 5.46268 5.6621 11.1396 9.91857 6.69157 6.56065 numMergedOcc 0
8 mol 156 unq 1 iso 0 dist 6.47989 5.50879 4.68339 6.00295 4.78734 6.65278 11.1396 9.91857 6.69157 10.3001 numMergedOcc 0
9 mol 193 unq 0 iso 0 dist 5.19654 8.71993 3.53549 6.28889 7.03947 9.08423 13.1729 9.16852 7.71716 16.1177 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 7.68078 8.94889 12.3142 8.78652 11.256 4.36112 8.21472 14.5232 8.50367 11.4809 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 7.68078 8.94889 12.3142 9.01437 12.6561 10.7545 8.21472 14.5232 8.50367 14.1202 numMergedOcc 0
12 mol 210 unq 2 iso 0 dist 9.26518 8.94889 13.7365 8.78652 11.3555 4.36112 8.21472 14.1507 8.50367 11.4809 numMergedOcc 0
13 mol 210 unq 3 iso 0 dist 9.26518 8.94889 13.7365 9.01437 4.94588 10.7545 8.21472 14.1507 8.50367 14.1202 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 9.05082 8.24741 12.3913 6.82883 7.93097 4.66376 8.0668 15.1102 5.07958 8.22518 numMergedOcc 0
15 mol 226 unq 1 iso 0 dist 9.05082 8.24741 12.3913 6.82883 7.93097 4.66376 12.401 12.6814 6.19519 6.02803 numMergedOcc 0
16 mol 226 unq 2 iso 0 dist 9.05082 8.24741 12.3913 6.95495 4.87605 13.3747 8.0668 15.1102 5.07958 14.6847 numMergedOcc 0
17 mol 226 unq 3 iso 0 dist 9.05082 8.24741 12.3913 6.95495 4.87605 13.3747 12.401 12.6814 6.19519 15.4825 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 9.36052 7.84151 10.402 8.16005 5.527 11.4694 6.91672 13.5125 7.346 14.3828 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 8.83777 6.40125 6.08499 7.88238 12.5151 11.8 11.8204 12.7326 7.25282 17.5131 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 9.42812 6.40125 10.3278 7.88238 5.10104 11.8 11.8204 15.5229 7.25282 17.5131 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.18179 7.14122 10.2078 7.61501 14.2071 6.2981 7.00034 8.87355 8.52827 11.9352 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 7.45556 7.14122 4.8005 7.61501 4.45759 6.2981 7.00034 12.022 8.52827 11.9352 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 5.25218 7.14122 8.61009 7.61501 5.65772 6.2981 7.00034 12.0184 8.52827 11.9352 numMergedOcc 0
