0 mol 41 unq 0 iso 0 dist 8.45063 10.7583 7.64235 6.24565 6.00623 4.51323 numMergedOcc 0
1 mol 41 unq 0 iso 1 dist 8.45063 6.24565 6.00623 10.7583 7.64235 4.51323 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 8.45063 10.7583 7.64235 5.14132 6.59367 9.41248 numMergedOcc 0
3 mol 41 unq 1 iso 1 dist 8.45063 5.14132 6.59367 10.7583 7.64235 9.41248 numMergedOcc 0
4 mol 41 unq 1 iso 0 dist 8.45063 6.24565 6.00623 5.14132 6.59367 5.84315 numMergedOcc 0
5 mol 41 unq 1 iso 1 dist 8.45063 5.14132 6.59367 6.24565 6.00623 5.84315 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 5.73908 3.89794 8.18002 9.05937 7.07032 8.15249 numMergedOcc 0
7 mol 68 unq 0 iso 1 dist 5.73908 9.05937 7.07032 3.89794 8.18002 8.15249 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 8.39608 6.82169 6.59302 13.8437 9.93626 10.8132 numMergedOcc 0
9 mol 71 unq 0 iso 1 dist 8.39608 13.8437 9.93626 6.82169 6.59302 10.8132 numMergedOcc 0
10 mol 71 unq 1 iso 0 dist 7.28815 10.5616 6.59302 6.46657 9.93626 10.8132 numMergedOcc 0
11 mol 71 unq 1 iso 1 dist 7.28815 6.46657 9.93626 10.5616 6.59302 10.8132 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 5.53726 4.43947 8.15236 11.8016 8.24447 11.4407 numMergedOcc 0
13 mol 92 unq 0 iso 1 dist 5.53726 11.8016 8.24447 4.43947 8.15236 11.4407 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.31333 9.58526 5.80433 11.0885 6.8285 4.84512 numMergedOcc 0
15 mol 186 unq 0 iso 1 dist 5.31333 11.0885 6.8285 9.58526 5.80433 4.84512 numMergedOcc 0
16 mol 187 unq 0 iso 0 dist 5.82577 9.55801 6.56642 5.94354 7.9625 12.4673 numMergedOcc 0
17 mol 187 unq 0 iso 1 dist 5.82577 5.94354 7.9625 9.55801 6.56642 12.4673 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 9.29888 8.59287 6.40309 11.9391 7.87164 5.39292 numMergedOcc 0
19 mol 238 unq 0 iso 1 dist 9.29888 11.9391 7.87164 8.59287 6.40309 5.39292 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 8.55211 10.3966 7.58405 5.51525 7.26115 5.69506 numMergedOcc 0
21 mol 260 unq 0 iso 1 dist 8.55211 5.51525 7.26115 10.3966 7.58405 5.69506 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 9.33791 6.11645 5.45375 5.7716 9.9145 6.89348 numMergedOcc 0
23 mol 266 unq 0 iso 1 dist 9.33791 5.7716 9.9145 6.11645 5.45375 6.89348 numMergedOcc 0
24 mol 273 unq 0 iso 0 dist 9.80002 14.2814 6.59786 17.5382 7.96519 7.54268 numMergedOcc 0
25 mol 273 unq 0 iso 1 dist 9.80002 17.5382 7.96519 14.2814 6.59786 7.54268 numMergedOcc 0
26 mol 273 unq 1 iso 0 dist 6.73794 9.11005 6.59786 13.7838 7.96519 7.54268 numMergedOcc 0
27 mol 273 unq 1 iso 1 dist 6.73794 13.7838 7.96519 9.11005 6.59786 7.54268 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 6.90956 4.26276 8.40198 9.92609 9.95761 14.0321 numMergedOcc 0
29 mol 287 unq 0 iso 1 dist 6.90956 9.92609 9.95761 4.26276 8.40198 14.0321 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 6.90956 4.26276 8.40198 9.92609 9.95761 14.0321 numMergedOcc 0
31 mol 288 unq 0 iso 1 dist 6.90956 9.92609 9.95761 4.26276 8.40198 14.0321 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 6.90956 4.26276 8.40198 9.92609 9.95761 14.0321 numMergedOcc 0
33 mol 289 unq 0 iso 1 dist 6.90956 9.92609 9.95761 4.26276 8.40198 14.0321 numMergedOcc 0
34 mol 293 unq 0 iso 0 dist 6.97887 4.37303 5.88449 11.0749 7.2668 7.08365 numMergedOcc 0
35 mol 293 unq 0 iso 1 dist 6.97887 11.0749 7.2668 4.37303 5.88449 7.08365 numMergedOcc 0
36 mol 293 unq 1 iso 0 dist 6.04186 4.37303 5.50284 11.0749 8.88355 7.08365 numMergedOcc 0
37 mol 293 unq 1 iso 1 dist 6.04186 11.0749 8.88355 4.37303 5.50284 7.08365 numMergedOcc 0
