0 mol 33 unq 0 iso 0 dist 5.31968 8.94949 9.08296 3.82411 7.89306 12.6778 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 5.31968 8.94949 9.08296 4.28598 8.36697 10.6106 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.12873 8.21985 7.99907 3.30756 7.93498 9.20861 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.73923 8.74341 6.03786 11.09 7.61377 12.2877 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.67696 6.75148 8.7251 10.8259 7.17133 13.1605 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 6.27877 7.46478 12.8729 3.81285 7.51319 5.61151 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 6.27877 7.46478 12.8729 6.17121 8.49887 6.54289 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 7.99359 9.07289 7.32307 7.21006 8.40918 13.9368 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 5.00698 9.46264 8.63299 11.5769 9.71312 8.98184 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.68406 6.96294 6.55605 6.8842 9.57243 6.40751 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 5.68406 6.96294 6.55605 6.46148 8.12558 11.6867 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 9.46329 9.76389 6.55605 5.05002 9.57243 6.40751 numMergedOcc 0
12 mol 141 unq 3 iso 0 dist 9.46329 9.76389 6.55605 12.4824 8.12558 11.6867 numMergedOcc 0
13 mol 151 unq 0 iso 0 dist 8.15628 9.14139 4.64142 6.07474 9.00461 10.5191 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 8.11014 4.54491 8.2618 8.24104 8.5544 11.9767 numMergedOcc 0
15 mol 193 unq 0 iso 0 dist 8.30095 7.03719 10.9154 5.57164 9.13587 11.8652 numMergedOcc 0
16 mol 193 unq 1 iso 0 dist 8.30095 9.06161 11.6584 5.57164 9.13587 6.17074 numMergedOcc 0
17 mol 193 unq 2 iso 0 dist 8.30095 8.97094 8.97716 5.57164 9.13587 11.342 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 6.17408 5.75996 6.59614 3.65952 8.99104 5.50017 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 6.17602 7.44932 6.59614 7.05149 8.99104 5.50017 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 8.43749 7.74463 8.3872 3.8221 6.18698 9.47153 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.70632 6.41474 13.5492 10.9606 9.32456 16.4661 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 8.08479 8.91185 12.8542 9.42852 7.36137 17.3246 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 8.08479 8.91185 12.8542 9.63536 4.95415 16.516 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 8.08479 9.28273 5.18289 9.42852 7.36137 11.9661 numMergedOcc 0
25 mol 266 unq 4 iso 0 dist 8.08479 9.28273 5.18289 9.63536 4.95415 9.73748 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 8.60635 9.97399 9.01459 6.85091 9.29687 3.93401 numMergedOcc 0
