0 mol 24 unq 0 iso 0 dist 7.84552 10.6642 4.87192 10.0962 7.18124 4.21283 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.84552 10.6642 4.87192 8.56474 6.47026 4.97191 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 8.57551 4.7474 7.43804 13.1291 9.52155 8.59444 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 8.57551 4.7474 7.43804 9.11983 9.16319 4.3825 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 9.32506 9.37609 7.43804 16.7181 9.52155 8.59444 numMergedOcc 0
5 mol 27 unq 3 iso 0 dist 9.32506 9.37609 7.43804 13.5691 9.16319 4.3825 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.00217 14.427 5.44028 5.08181 8.32093 13.0221 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 8.72121 5.17882 9.29087 12.1308 6.69121 14.0343 numMergedOcc 0
8 mol 107 unq 0 iso 0 dist 8.93032 11.458 5.9385 11.0987 8.15179 5.0838 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 9.01984 5.4197 6.98727 9.11894 7.24101 3.75797 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 9.56199 8.76901 5.70499 6.3119 7.02043 4.9293 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 8.9675 11.8677 6.61386 15.0962 9.82522 9.47921 numMergedOcc 0
12 mol 154 unq 1 iso 0 dist 8.9675 11.8677 6.61386 14.8962 8.50773 3.48213 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 7.80955 7.6506 6.00293 7.86779 9.67872 5.21512 numMergedOcc 0
14 mol 162 unq 1 iso 0 dist 6.66396 7.2417 6.00293 12.3596 9.67872 5.21512 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.49617 8.43505 5.96238 13.1148 8.42716 6.72925 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 9.49617 11.501 7.85966 13.1148 8.42716 10.2944 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 9.15508 6.01148 5.96238 3.50159 8.42716 6.72925 numMergedOcc 0
18 mol 205 unq 3 iso 0 dist 9.15508 8.17894 7.85966 3.50159 8.42716 10.2944 numMergedOcc 0
19 mol 205 unq 4 iso 0 dist 8.54088 6.01148 8.24405 11.2784 9.66947 7.1653 numMergedOcc 0
20 mol 205 unq 5 iso 0 dist 8.54088 6.01148 8.24405 3.50159 5.69652 6.72925 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 9.92712 8.50924 9.23268 6.90422 9.63062 13.313 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 7.5725 5.02022 7.81987 4.45276 8.89873 8.20635 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 7.7033 11.8444 9.96989 6.4179 5.3772 5.85068 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 7.7033 11.8444 9.96989 11.4354 7.59138 12.3165 numMergedOcc 0
