0 mol 9 unq 0 iso 0 dist 9.82483 6.0397 8.076 11.6997 8.88528 7.35972 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.82483 6.0397 8.076 14.5309 14.0736 9.93542 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.62284 5.90981 9.69752 13.2857 11.9395 8.00171 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.62284 13.719 9.36461 13.2857 11.9395 6.72323 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.42581 11.553 6.74848 5.497 5.45023 6.56527 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 9.17518 9.05795 7.03307 13.4333 5.1728 7.48846 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 8.21833 11.814 7.03307 13.2979 5.1728 7.48846 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.30176 5.54732 8.29345 6.95465 9.01596 9.91054 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 8.06525 9.47219 9.35942 12.825 10.5177 8.42878 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.39683 10.8622 5.44303 14.0282 5.66194 5.87084 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 7.59814 6.15037 7.82544 10.5533 5.61022 6.84835 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 7.59814 6.15037 7.82544 13.541 12.8357 8.42748 numMergedOcc 0
12 mol 133 unq 2 iso 0 dist 8.07135 6.61001 6.18808 7.41399 5.71483 6.84835 numMergedOcc 0
13 mol 133 unq 3 iso 0 dist 8.07135 6.61001 6.18808 6.71555 5.83691 8.42748 numMergedOcc 0
14 mol 133 unq 4 iso 0 dist 9.7775 6.15037 6.18808 10.5533 5.71483 6.84835 numMergedOcc 0
15 mol 133 unq 5 iso 0 dist 9.7775 6.15037 6.18808 13.541 5.83691 8.42748 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 7.345 9.87435 7.11785 14.6631 8.30281 7.22883 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 9.52987 14.6648 7.11785 17.8119 8.30281 7.22883 numMergedOcc 0
18 mol 193 unq 0 iso 0 dist 7.94747 4.17434 8.67745 7.60625 6.03632 9.40801 numMergedOcc 0
19 mol 193 unq 1 iso 0 dist 8.76185 10.8409 7.8141 10.3878 3.98356 9.40801 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 9.77862 5.63279 5.68348 9.3402 7.50057 6.38324 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 9.77862 5.63279 5.68348 11.6497 5.92931 6.1886 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.29542 9.51752 9.23935 10.8228 8.98957 8.37739 numMergedOcc 0
23 mol 225 unq 1 iso 0 dist 7.29542 10.9596 7.77552 10.8228 8.98957 9.47237 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 7.33613 9.55218 5.06628 9.27395 5.90415 8.10254 numMergedOcc 0
25 mol 250 unq 0 iso 0 dist 9.03319 4.45194 5.93798 12.0227 12.4255 9.70149 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 7.25677 6.56697 7.85414 6.43034 5.43373 8.20644 numMergedOcc 0
