0 mol 9 unq 0 iso 0 dist 7.71101 9.95642 7.84963 16.0471 11.9461 6.76332 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 5.32613 6.27808 7.84963 12.6241 11.9461 6.76332 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.10885 9.60284 8.44792 19.4417 15.5107 9.96463 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.942 5.79552 8.79378 7.06922 11.8315 9.98353 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.90147 9.53452 4.90216 18.0233 12.2061 8.69443 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 6.9741 3.98162 4.90216 11.5803 12.2061 8.69443 numMergedOcc 0
6 mol 59 unq 2 iso 0 dist 7.92225 5.90701 8.69574 9.37527 5.66067 6.34078 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.42645 3.91116 7.25138 10.8045 12.5032 9.3913 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 7.85115 6.21393 5.53454 6.13194 5.59536 6.71671 numMergedOcc 0
9 mol 123 unq 0 iso 0 dist 8.09329 7.43229 8.30974 12.161 5.58056 9.28454 numMergedOcc 0
10 mol 123 unq 1 iso 0 dist 8.09329 7.43229 8.30974 14.1998 10.0663 7.97266 numMergedOcc 0
11 mol 123 unq 2 iso 0 dist 6.13025 7.19969 8.30974 9.33367 5.58056 9.28454 numMergedOcc 0
12 mol 123 unq 3 iso 0 dist 6.13025 7.19969 8.30974 12.219 10.0663 7.97266 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 7.84085 9.45934 4.82356 4.84604 3.75786 6.85651 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 7.84085 5.10912 8.83476 4.84604 3.75786 7.03858 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 8.99827 5.92269 6.81449 7.76167 3.56704 6.60739 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 8.99827 5.92269 6.81449 8.63766 5.6048 9.22427 numMergedOcc 0
17 mol 148 unq 2 iso 0 dist 8.99827 5.92269 6.81449 8.42082 8.33576 5.55129 numMergedOcc 0
18 mol 150 unq 0 iso 0 dist 8.97634 5.95123 6.87593 7.83202 3.56413 6.71763 numMergedOcc 0
19 mol 150 unq 1 iso 0 dist 8.97634 5.95123 6.87593 8.7107 5.53516 9.32504 numMergedOcc 0
20 mol 150 unq 2 iso 0 dist 8.97634 5.95123 6.87593 8.47493 8.23832 5.53778 numMergedOcc 0
21 mol 154 unq 0 iso 0 dist 8.12953 13.5449 8.26128 8.4581 4.8443 7.31277 numMergedOcc 0
22 mol 237 unq 0 iso 0 dist 5.27463 5.61195 7.69237 8.81333 6.50729 8.37331 numMergedOcc 0
23 mol 257 unq 0 iso 0 dist 6.19418 10.3089 9.82105 17.4347 14.4499 8.9297 numMergedOcc 0
24 mol 269 unq 0 iso 0 dist 6.53779 4.50547 6.72096 6.78303 4.41005 7.97206 numMergedOcc 0
25 mol 269 unq 1 iso 0 dist 6.53779 5.57581 9.18157 6.78303 4.41005 7.1068 numMergedOcc 0
26 mol 269 unq 2 iso 0 dist 6.02501 6.37646 6.72096 8.89706 4.41005 7.97206 numMergedOcc 0
27 mol 269 unq 3 iso 0 dist 6.02501 8.94147 9.18157 8.89706 4.41005 7.1068 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 6.70519 9.32871 7.48987 5.49473 4.99494 5.27236 numMergedOcc 0
