0 mol 17 unq 0 iso 0 dist 8.2298 10.4593 8.48453 6.57611 8.80499 5.14154 numMergedOcc 0
1 mol 17 unq 0 iso 1 dist 8.2298 6.57611 8.80499 10.4593 8.48453 5.14154 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.57343 11.6128 9.31319 6.124 8.2513 7.32297 numMergedOcc 0
3 mol 46 unq 0 iso 1 dist 9.57343 6.124 8.2513 11.6128 9.31319 7.32297 numMergedOcc 0
4 mol 66 unq 0 iso 0 dist 7.59498 11.9477 8.04639 9.87898 7.69019 9.61194 numMergedOcc 0
5 mol 66 unq 0 iso 1 dist 7.59498 9.87898 7.69019 11.9477 8.04639 9.61194 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.28709 9.17087 7.95122 5.33532 9.74268 5.22626 numMergedOcc 0
7 mol 70 unq 0 iso 1 dist 9.28709 5.33532 9.74268 9.17087 7.95122 5.22626 numMergedOcc 0
8 mol 122 unq 0 iso 0 dist 6.12598 5.24418 7.43775 9.66073 8.09594 5.6661 numMergedOcc 0
9 mol 122 unq 0 iso 1 dist 6.12598 9.66073 8.09594 5.24418 7.43775 5.6661 numMergedOcc 0
10 mol 122 unq 1 iso 0 dist 7.15796 9.42426 7.43775 5.77589 8.09594 5.6661 numMergedOcc 0
11 mol 122 unq 1 iso 1 dist 7.15796 5.77589 8.09594 9.42426 7.43775 5.6661 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 7.33878 11.9395 9.7168 8.04205 7.38138 8.05787 numMergedOcc 0
13 mol 148 unq 0 iso 1 dist 7.33878 8.04205 7.38138 11.9395 9.7168 8.05787 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 7.48646 11.9366 9.61132 7.9422 7.34423 8.10457 numMergedOcc 0
15 mol 150 unq 0 iso 1 dist 7.48646 7.9422 7.34423 11.9366 9.61132 8.10457 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 7.03206 5.6926 7.39961 4.88441 7.80643 5.76755 numMergedOcc 0
17 mol 156 unq 0 iso 1 dist 7.03206 4.88441 7.80643 5.6926 7.39961 5.76755 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 6.58684 4.91992 8.50904 7.91395 7.04318 6.2715 numMergedOcc 0
19 mol 175 unq 0 iso 1 dist 6.58684 7.91395 7.04318 4.91992 8.50904 6.2715 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 9.71689 10.1816 7.92766 7.7596 6.32652 12.5143 numMergedOcc 0
21 mol 204 unq 0 iso 1 dist 9.71689 7.7596 6.32652 10.1816 7.92766 12.5143 numMergedOcc 0
22 mol 213 unq 0 iso 0 dist 8.74491 7.15202 9.40939 11.621 9.06306 11.2306 numMergedOcc 0
23 mol 213 unq 0 iso 1 dist 8.74491 11.621 9.06306 7.15202 9.40939 11.2306 numMergedOcc 0
24 mol 241 unq 0 iso 0 dist 8.67228 11.9557 8.98617 7.40926 6.74552 8.13129 numMergedOcc 0
25 mol 241 unq 0 iso 1 dist 8.67228 7.40926 6.74552 11.9557 8.98617 8.13129 numMergedOcc 0
