0 mol 26 unq 0 iso 0 dist 5.81836 8.35396 5.45023 12.1179 7.90721 6.7142 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.01135 5.78969 4.16161 13.1866 9.80137 10.6893 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 5.01135 5.78969 4.16161 12.4944 8.34893 10.3169 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 5.20384 5.7898 4.20245 13.5294 9.85865 10.6858 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 5.20384 5.7898 4.20245 13.1293 8.74946 10.7881 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.44028 9.59959 13.7484 5.69088 8.05514 10.6667 numMergedOcc 0
6 mol 68 unq 1 iso 0 dist 5.44028 9.33762 11.9362 5.69088 8.05514 10.0742 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.64989 9.69315 9.43915 4.3232 5.17145 8.4701 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.88404 7.90709 15.382 3.29302 6.99125 9.78006 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 8.88404 9.03842 12.612 3.29302 6.99125 9.27009 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 7.75632 6.73995 6.29877 3.36092 9.13027 9.19622 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.9637 7.51714 5.80425 5.33111 8.17226 8.92115 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 9.18343 7.93342 8.98957 18.0348 9.87668 16.0999 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 9.18343 7.93342 8.98957 16.9616 8.42121 17.1195 numMergedOcc 0
14 mol 225 unq 2 iso 0 dist 9.18343 7.93342 8.98957 9.03441 7.8744 6.94762 numMergedOcc 0
15 mol 225 unq 3 iso 0 dist 9.18343 7.93342 8.98957 6.0078 4.98402 10.1785 numMergedOcc 0
16 mol 251 unq 0 iso 0 dist 6.12282 7.81441 7.04387 9.65596 6.42747 13.1165 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 9.28899 6.05239 14.2062 11.6874 9.30437 16.9922 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 7.92718 9.51705 10.6303 9.86711 8.63072 16.7098 numMergedOcc 0
19 mol 278 unq 1 iso 0 dist 7.92718 9.51705 10.6303 4.4084 7.59696 12.3123 numMergedOcc 0
