0 mol 6 unq 0 iso 0 dist 7.77032 7.41557 6.62861 11.218 13.1336 6.69921 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 7.66321 7.41235 5.72091 7.7664 12.5979 9.40953 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.66321 9.00377 6.49805 7.7664 12.5979 9.57896 numMergedOcc 0
3 mol 36 unq 0 iso 0 dist 7.38433 6.02824 3.35055 5.71189 8.88147 6.1084 numMergedOcc 0
4 mol 36 unq 1 iso 0 dist 9.0321 6.1084 12.2373 5.71189 13.8074 6.02824 numMergedOcc 0
5 mol 36 unq 2 iso 0 dist 8.88147 6.1084 3.35055 5.71189 7.38433 6.02824 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 5.97363 8.2282 6.88888 8.27485 10.0152 4.88863 numMergedOcc 0
7 mol 71 unq 0 iso 0 dist 6.01135 5.21993 3.64347 6.48383 9.08264 5.73879 numMergedOcc 0
8 mol 71 unq 1 iso 0 dist 9.08264 5.73879 3.64347 6.48383 6.01135 5.21993 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 7.74797 8.06358 4.28553 10.1334 12.4841 9.83729 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 9.43033 8.18122 7.20593 12.0154 12.7002 8.36221 numMergedOcc 0
11 mol 123 unq 1 iso 0 dist 9.43033 8.18122 7.20593 13.4796 11.4423 8.6441 numMergedOcc 0
12 mol 123 unq 2 iso 0 dist 9.43033 8.18122 7.20593 5.33782 9.93167 6.70684 numMergedOcc 0
13 mol 123 unq 3 iso 0 dist 8.57379 8.36221 6.48535 12.0154 14.3461 8.18122 numMergedOcc 0
14 mol 123 unq 4 iso 0 dist 8.57379 8.36221 6.48535 3.65652 6.82663 8.6441 numMergedOcc 0
15 mol 123 unq 5 iso 0 dist 8.57379 8.36221 6.48535 6.84294 11.4155 6.70684 numMergedOcc 0
16 mol 123 unq 6 iso 0 dist 5.87154 8.6441 11.3179 13.4796 16.717 8.18122 numMergedOcc 0
17 mol 123 unq 7 iso 0 dist 5.87154 8.6441 11.3179 3.65652 9.50933 8.36221 numMergedOcc 0
18 mol 123 unq 8 iso 0 dist 5.87154 8.6441 11.3179 8.81087 13.1465 6.70684 numMergedOcc 0
19 mol 123 unq 9 iso 0 dist 6.82663 8.6441 6.48535 13.4796 14.3461 8.18122 numMergedOcc 0
20 mol 123 unq 10 iso 0 dist 6.82663 8.6441 6.48535 3.65652 8.57379 8.36221 numMergedOcc 0
21 mol 123 unq 11 iso 0 dist 6.82663 8.6441 6.48535 8.81087 11.4155 6.70684 numMergedOcc 0
22 mol 123 unq 12 iso 0 dist 9.93167 6.70684 7.20593 5.33782 9.43033 8.18122 numMergedOcc 0
23 mol 123 unq 13 iso 0 dist 9.93167 6.70684 7.20593 6.84294 12.7002 8.36221 numMergedOcc 0
24 mol 123 unq 14 iso 0 dist 9.93167 6.70684 7.20593 8.81087 11.4423 8.6441 numMergedOcc 0
25 mol 148 unq 0 iso 0 dist 9.62458 9.8506 16.1985 8.87503 17.0197 6.02506 numMergedOcc 0
26 mol 150 unq 0 iso 0 dist 9.64273 9.91991 16.2155 8.95308 17.1071 6.07854 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 8.04755 6.73229 4.09885 5.50617 9.51193 7.8428 numMergedOcc 0
