0 mol 1 unq 0 iso 0 dist 8.93851 8.93702 12.4382 7.48521 13.546 5.96833 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.35447 8.16769 4.39214 6.9246 8.3307 6.016 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.35447 8.50453 4.76457 6.9246 8.3307 8.38156 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 9.35447 8.50453 4.76457 12.5287 12.5429 7.79336 numMergedOcc 0
4 mol 34 unq 3 iso 0 dist 9.35447 8.50453 4.76457 13.6582 11.419 7.08559 numMergedOcc 0
5 mol 34 unq 4 iso 0 dist 4.97286 5.73257 5.32588 6.65242 11.1334 8.63635 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 5.99047 9.46609 6.71645 3.62638 7.50377 7.95451 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 6.45731 6.12126 5.40594 5.61773 5.64587 6.47811 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.58727 4.95674 13.0351 7.44092 10.3522 8.55349 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 8.61597 4.95674 4.40152 7.44092 11.716 8.55349 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.11189 5.98435 13.6923 4.72407 8.73668 6.44575 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 8.11189 5.98435 13.6923 7.97297 11.603 7.43401 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 8.11189 8.80672 9.50813 6.67639 9.1813 5.73203 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 8.11189 8.80672 9.50813 4.4987 4.73115 6.57379 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 7.59345 6.91289 8.15467 8.23396 13.563 8.42899 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 7.66236 6.895 8.14618 7.40922 13.2924 8.33721 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.46442 6.31342 5.14615 4.94099 8.09016 5.93063 numMergedOcc 0
17 mol 228 unq 0 iso 0 dist 9.60884 9.79291 5.19012 14.2513 12.0197 8.66946 numMergedOcc 0
18 mol 228 unq 1 iso 0 dist 9.60884 9.79291 5.19012 11.0879 12.6739 8.55761 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.85333 5.34745 13.091 6.49444 14.3797 8.24424 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 9.85333 5.34745 13.091 6.63339 16.0531 7.0942 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 9.85333 5.34745 13.091 9.86764 17.8847 6.01775 numMergedOcc 0
22 mol 233 unq 3 iso 0 dist 8.08374 7.99897 10.3247 9.1334 9.31086 8.24424 numMergedOcc 0
23 mol 233 unq 4 iso 0 dist 8.08374 7.99897 10.3247 9.81222 11.9113 7.0942 numMergedOcc 0
24 mol 233 unq 5 iso 0 dist 8.08374 7.99897 10.3247 5.17683 11.6346 6.01775 numMergedOcc 0
25 mol 233 unq 6 iso 0 dist 8.2689 7.99897 13.0238 9.1334 16.8252 8.24424 numMergedOcc 0
26 mol 233 unq 7 iso 0 dist 8.2689 7.99897 13.0238 9.81222 17.536 7.0942 numMergedOcc 0
27 mol 233 unq 8 iso 0 dist 8.2689 7.99897 13.0238 5.17683 12.1209 6.01775 numMergedOcc 0
28 mol 233 unq 9 iso 0 dist 9.02739 8.98366 9.47705 12.3327 17.0911 8.24424 numMergedOcc 0
29 mol 233 unq 10 iso 0 dist 9.02739 8.98366 9.47705 8.89879 14.6975 7.0942 numMergedOcc 0
30 mol 233 unq 11 iso 0 dist 9.02739 8.98366 9.47705 9.7363 12.6079 6.01775 numMergedOcc 0
31 mol 234 unq 0 iso 0 dist 6.99317 7.54327 6.90118 16.363 15.2484 9.11572 numMergedOcc 0
32 mol 267 unq 0 iso 0 dist 6.54894 8.87518 4.62072 11.6034 5.463 6.32877 numMergedOcc 0
33 mol 267 unq 1 iso 0 dist 6.54894 8.87518 4.62072 12.9552 9.18812 9.48115 numMergedOcc 0
34 mol 267 unq 2 iso 0 dist 6.54894 8.87518 4.62072 5.23612 8.68244 8.38545 numMergedOcc 0
35 mol 267 unq 3 iso 0 dist 6.54894 8.87518 4.62072 10.1261 8.82546 5.08174 numMergedOcc 0
36 mol 267 unq 4 iso 0 dist 6.54894 8.87518 4.62072 9.74815 9.46729 6.10838 numMergedOcc 0
