0 mol 20 unq 0 iso 0 dist 9.81561 9.00405 9.38691 12.2773 6.36152 8.93826 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.81561 9.00405 9.38691 8.67226 3.78294 7.17695 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 9.88078 9.00405 8.65986 12.2773 9.33614 8.93826 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 9.88078 9.00405 8.65986 8.67226 6.48654 7.17695 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 9.88078 7.86889 9.39462 8.67226 6.48654 9.33207 numMergedOcc 0
5 mol 20 unq 5 iso 0 dist 7.53599 9.00405 9.74724 12.2773 12.0458 8.93826 numMergedOcc 0
6 mol 20 unq 6 iso 0 dist 7.53599 9.00405 9.74724 8.67226 8.39164 7.17695 numMergedOcc 0
7 mol 20 unq 7 iso 0 dist 7.53599 7.86889 9.13347 8.67226 8.39164 9.33207 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 7.94809 10.2302 8.32093 14.2766 9.10734 5.57551 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 6.21509 8.14689 9.43682 10.792 9.38441 9.16089 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 5.7306 15.1721 9.82522 19.2112 13.9898 9.99331 numMergedOcc 0
11 mol 154 unq 1 iso 0 dist 5.7306 15.1721 9.82522 16.0026 11.0213 8.44389 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 4.74768 5.60897 7.33178 12.5546 13.3477 8.95296 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 4.74768 5.60897 7.33178 9.08229 7.86284 6.10021 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.87925 9.15827 9.64977 16.4451 13.3009 9.14525 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.254 3.30102 5.69652 8.95136 12.6877 8.87165 numMergedOcc 0
16 mol 254 unq 0 iso 0 dist 8.10339 7.43463 6.56151 15.192 9.71492 9.09568 numMergedOcc 0
17 mol 254 unq 1 iso 0 dist 8.10339 7.43463 6.56151 10.8819 3.58476 7.84221 numMergedOcc 0
18 mol 254 unq 2 iso 0 dist 8.10339 9.17605 8.3417 15.192 9.71492 9.99168 numMergedOcc 0
19 mol 254 unq 3 iso 0 dist 8.10339 9.17605 8.3417 10.8819 3.58476 9.67383 numMergedOcc 0
20 mol 254 unq 4 iso 0 dist 8.81893 11.49 6.56151 17.1133 9.71492 9.09568 numMergedOcc 0
21 mol 254 unq 5 iso 0 dist 8.81893 11.49 6.56151 11.2547 3.58476 7.84221 numMergedOcc 0
22 mol 254 unq 6 iso 0 dist 8.81893 13.615 8.3417 17.1133 9.71492 9.99168 numMergedOcc 0
23 mol 254 unq 7 iso 0 dist 8.81893 13.615 8.3417 11.2547 3.58476 9.67383 numMergedOcc 0
24 mol 254 unq 8 iso 0 dist 8.59635 7.43463 6.58752 15.192 8.60551 9.09568 numMergedOcc 0
25 mol 254 unq 9 iso 0 dist 8.59635 7.43463 6.58752 10.8819 7.04985 7.84221 numMergedOcc 0
26 mol 268 unq 0 iso 0 dist 8.49518 8.09464 8.00345 10.5466 4.29831 6.18877 numMergedOcc 0
27 mol 270 unq 0 iso 0 dist 8.19788 10.3541 6.85081 10.442 6.1174 7.97614 numMergedOcc 0
