0 mol 5 unq 0 iso 0 dist 8.30937 10.0561 8.81964 12.4817 8.49537 3.9731 15.5715 7.69461 10.9825 8.34817 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 6.64844 10.0955 7.43338 8.59614 7.44805 8.28528 8.89554 3.66253 6.03151 5.4713 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 4.93315 7.39957 9.60892 4.85685 8.96898 7.10506 5.6359 5.91118 12.9638 9.19512 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.49371 11.3498 9.26231 15.9372 9.50939 14.6307 15.0634 6.1999 12.3818 5.45099 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 5.05941 8.10722 9.26231 14.3512 9.50939 14.6307 10.3895 6.1999 12.3818 5.45099 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 9.66942 5.66928 9.26231 17.8535 9.50939 14.6307 14.595 6.1999 12.3818 5.45099 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 9.94668 7.73766 4.59484 13.7953 8.82481 6.65338 14.4443 5.35456 8.09699 9.68512 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 5.8391 6.03168 9.23669 3.31938 8.98633 5.41527 9.90751 11.5496 11.0468 9.36334 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 9.92924 12.4493 9.23669 9.96639 8.98633 5.41527 17.5724 11.5496 11.0468 9.36334 numMergedOcc 0
9 mol 228 unq 0 iso 0 dist 8.27678 5.37564 8.09971 14.9784 9.45974 12.157 11.0421 4.6339 11.6487 8.92379 numMergedOcc 0
10 mol 228 unq 1 iso 0 dist 9.75578 6.19505 8.09971 13.5698 9.45974 12.157 14.1643 4.6339 11.6487 8.92379 numMergedOcc 0
11 mol 228 unq 2 iso 0 dist 8.73196 10.0503 8.09971 6.12039 9.45974 12.157 10.9305 4.6339 11.6487 8.92379 numMergedOcc 0
12 mol 228 unq 3 iso 0 dist 8.52422 9.3381 6.97798 6.33222 9.86348 11.1565 10.6245 4.61961 9.96994 9.06403 numMergedOcc 0
13 mol 228 unq 4 iso 0 dist 8.26664 5.52794 6.97798 15.5519 9.86348 11.1565 10.9688 4.61961 9.96994 9.06403 numMergedOcc 0
14 mol 228 unq 5 iso 0 dist 9.33596 5.56223 6.97798 15.8419 9.86348 11.1565 13.4829 4.61961 9.96994 9.06403 numMergedOcc 0
15 mol 228 unq 6 iso 0 dist 9.68484 7.50953 6.97798 14.0401 9.86348 11.1565 14.0653 4.61961 9.96994 9.06403 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 8.67835 6.0591 8.13605 7.91474 4.76164 8.05498 15.7202 14.0954 15.4234 9.73217 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 8.67835 6.0591 8.13605 7.91474 4.76164 8.05498 6.54521 4.58993 8.29663 7.49606 numMergedOcc 0
18 mol 260 unq 2 iso 0 dist 8.67835 6.0591 8.13605 7.91474 4.76164 8.05498 11.1285 3.69763 11.2032 8.06377 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 9.53867 14.7732 9.24592 5.28038 5.55176 10.326 9.51394 5.06236 10.7645 4.93516 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 9.53867 14.7732 9.24592 5.28038 5.55176 10.326 9.51394 5.06236 10.7645 4.93516 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 9.53867 14.7732 9.24592 5.28038 5.55176 10.326 9.51394 5.06236 10.7645 4.93516 numMergedOcc 0
