0 mol 2 unq 0 iso 0 dist 7.1956 5.69072 8.26052 7.60935 6.20029 6.93149 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 5.60121 6.53312 4.98223 5.98169 7.05692 10.6136 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 5.64624 5.9948 4.98223 6.76158 10.3431 11.7233 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 5.64624 5.9948 4.98223 7.423 12.3064 13.0183 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 5.64624 5.9948 4.98223 5.89257 11.3495 10.9699 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.39911 7.55854 6.41876 9.29102 7.37466 3.60325 numMergedOcc 0
6 mol 53 unq 0 iso 0 dist 9.82468 7.6912 9.39654 7.03969 11.4001 3.43614 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 7.69318 6.49446 3.91116 6.0827 7.49995 6.13411 numMergedOcc 0
8 mol 65 unq 0 iso 0 dist 8.14002 7.62028 8.82113 9.42411 11.4608 9.27421 numMergedOcc 0
9 mol 65 unq 1 iso 0 dist 8.14002 9.61118 12.0591 9.42411 11.4608 9.72356 numMergedOcc 0
10 mol 65 unq 2 iso 0 dist 8.14002 8.72097 9.09593 9.42411 11.4608 13.0357 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 5.45739 8.80094 4.48341 8.47439 10.7396 15.207 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 5.45739 9.03681 13.7826 8.47439 10.7396 10.3454 numMergedOcc 0
13 mol 168 unq 2 iso 0 dist 6.75751 8.80094 15.3661 8.47439 9.33959 15.207 numMergedOcc 0
14 mol 168 unq 3 iso 0 dist 6.75751 9.03681 5.35061 8.47439 9.33959 10.3454 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 6.22076 7.7195 7.58118 6.80203 4.73385 11.244 numMergedOcc 0
16 mol 171 unq 1 iso 0 dist 6.22076 9.43988 10.1355 6.80203 4.73385 5.58661 numMergedOcc 0
17 mol 171 unq 2 iso 0 dist 8.30602 8.30819 7.58118 8.00826 4.73385 11.244 numMergedOcc 0
18 mol 176 unq 0 iso 0 dist 6.3518 8.08891 12.148 8.89556 14.1247 3.58164 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 9.11905 8.79012 15.9613 7.13397 15.3292 3.48905 numMergedOcc 0
20 mol 260 unq 1 iso 0 dist 9.11905 8.79012 15.9613 5.33278 8.1257 8.84611 numMergedOcc 0
21 mol 260 unq 2 iso 0 dist 7.56352 8.79012 14.4278 7.13397 11.5791 3.48905 numMergedOcc 0
22 mol 260 unq 3 iso 0 dist 7.56352 8.79012 14.4278 5.33278 8.99868 8.84611 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 6.63595 6.20857 11.2522 7.08918 6.21674 8.90381 numMergedOcc 0
