0 mol 5 unq 0 iso 0 dist 8.30937 12.4817 8.49537 15.5715 7.69461 8.34817 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.59212 9.32742 6.70325 13.1508 4.80254 8.97754 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 9.63542 3.24351 7.72377 11.5166 9.9172 8.78511 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.78064 4.96658 9.99145 8.87762 6.75665 9.41098 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 6.64844 8.59614 7.44805 8.89554 3.66253 5.4713 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 9.56769 6.84869 8.988 5.14123 4.45758 6.23509 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 4.93315 4.85685 8.96898 5.6359 5.91118 9.19512 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 7.72671 5.88789 9.10001 5.35145 3.83735 5.88409 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 9.49371 15.9372 9.50939 15.0634 6.1999 5.45099 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 5.05941 14.3512 9.50939 10.3895 6.1999 5.45099 numMergedOcc 0
10 mol 76 unq 2 iso 0 dist 9.66942 17.8535 9.50939 14.595 6.1999 5.45099 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 9.94668 13.7953 8.82481 14.4443 5.35456 9.68512 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 5.8391 3.31938 8.98633 9.90751 11.5496 9.36334 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 9.92924 9.96639 8.98633 17.5724 11.5496 9.36334 numMergedOcc 0
14 mol 228 unq 0 iso 0 dist 8.27678 14.9784 9.45974 11.0421 4.6339 8.92379 numMergedOcc 0
15 mol 228 unq 1 iso 0 dist 9.75578 13.5698 9.45974 14.1643 4.6339 8.92379 numMergedOcc 0
16 mol 228 unq 2 iso 0 dist 8.73196 6.12039 9.45974 10.9305 4.6339 8.92379 numMergedOcc 0
17 mol 228 unq 3 iso 0 dist 8.52422 6.33222 9.86348 10.6245 4.61961 9.06403 numMergedOcc 0
18 mol 228 unq 4 iso 0 dist 8.26664 15.5519 9.86348 10.9688 4.61961 9.06403 numMergedOcc 0
19 mol 228 unq 5 iso 0 dist 9.33596 15.8419 9.86348 13.4829 4.61961 9.06403 numMergedOcc 0
20 mol 228 unq 6 iso 0 dist 9.68484 14.0401 9.86348 14.0653 4.61961 9.06403 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 7.95378 5.9338 4.44509 11.4641 4.08014 7.97504 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 8.67835 7.91474 4.76164 15.7202 14.0954 9.73217 numMergedOcc 0
23 mol 260 unq 1 iso 0 dist 8.67835 7.91474 4.76164 6.54521 4.58993 7.49606 numMergedOcc 0
24 mol 260 unq 2 iso 0 dist 8.67835 7.91474 4.76164 11.1285 3.69763 8.06377 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 9.53867 5.28038 5.55176 9.51394 5.06236 4.93516 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.53867 5.28038 5.55176 9.51394 5.06236 4.93516 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 9.53867 5.28038 5.55176 9.51394 5.06236 4.93516 numMergedOcc 0
