0 mol 12 unq 0 iso 0 dist 8.34132 8.3933 10.763 6.16894 8.98466 6.6051 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.88657 9.36795 16.4149 6.58303 5.71901 14.418 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 9.52043 8.53522 5.21506 4.8523 8.84148 5.52834 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.81722 8.65565 16.3901 12.7037 5.39171 20.5363 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.27446 8.70465 4.63063 14.5698 9.27355 12.702 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 9.76332 8.70465 4.68175 14.5698 8.60363 12.702 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 9.76332 8.70465 4.68175 6.15303 9.27331 7.45777 numMergedOcc 0
7 mol 136 unq 0 iso 0 dist 7.43436 9.87892 7.92003 6.46069 9.33635 14.2607 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 9.76509 7.74764 6.12748 6.46011 7.02662 6.72718 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 4.99993 7.76744 3.96154 5.38715 4.58291 8.51153 numMergedOcc 0
10 mol 217 unq 0 iso 0 dist 9.30247 8.04881 11.0189 9.14625 6.01666 14.5269 numMergedOcc 0
11 mol 217 unq 1 iso 0 dist 9.30247 9.0875 8.60665 9.14625 6.01666 10.2919 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 9.46904 9.57192 17.5761 5.55077 8.34832 10.7912 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 8.75137 5.36183 10.254 13.7221 6.18866 16.2589 numMergedOcc 0
14 mol 249 unq 1 iso 0 dist 7.82699 5.36183 8.81984 13.7221 9.3807 16.2589 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 4.1077 8.88803 11.3568 7.32832 9.18439 15.2183 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 5.73065 4.66834 10.3278 8.3109 6.23539 11.8319 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 5.73065 8.90911 5.95045 8.3109 6.23539 6.66936 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 7.9542 9.12017 6.14106 4.93146 6.7897 10.2282 numMergedOcc 0
19 mol 281 unq 1 iso 0 dist 7.9542 5.84757 4.37855 4.93146 6.7897 6.58925 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 9.91042 9.00901 7.87494 14.1974 5.76337 9.77023 numMergedOcc 0
21 mol 294 unq 1 iso 0 dist 9.91042 9.00901 7.87494 15.7275 8.60441 16.275 numMergedOcc 0
