0 mol 29 unq 0 iso 0 dist 8.26334 9.34187 7.08841 10.3685 3.44035 5.34723 numMergedOcc 0
1 mol 29 unq 1 iso 0 dist 7.68854 4.78536 7.08841 6.80828 3.44035 5.34723 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 7.29783 7.9487 9.65897 8.70331 5.33785 5.9972 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.88243 12.0778 7.03126 18.3747 11.7295 8.88313 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.88243 12.0778 7.03126 12.5246 5.77163 5.48837 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 9.11547 5.26193 9.84457 7.27275 3.62998 9.51981 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 9.70788 13.1446 8.18023 18.95 14.4074 8.08798 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 8.39573 11.4382 6.76746 17.8667 11.4645 6.91878 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 5.81438 5.64245 5.3819 8.77524 5.80328 4.51124 numMergedOcc 0
9 mol 204 unq 1 iso 0 dist 5.81438 5.64245 5.3819 8.59764 3.68217 8.41517 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 6.0155 12.5858 9.58372 9.01979 3.64285 7.72298 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 8.94981 13.2718 8.91356 14.6143 14.9585 9.27079 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 8.68934 8.2025 8.27411 13.7154 12.9557 5.69634 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 8.68934 10.6553 7.36208 13.7154 12.9557 7.91374 numMergedOcc 0
14 mol 254 unq 0 iso 0 dist 8.98141 9.73337 9.66641 12.6066 8.8967 7.23916 numMergedOcc 0
15 mol 254 unq 1 iso 0 dist 8.98141 9.73337 9.66641 13.8011 10.929 6.12653 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.40328 10.0667 6.23661 17.7592 11.169 9.28024 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 9.83098 8.02451 8.51504 12.8591 3.34167 9.66832 numMergedOcc 0
18 mol 286 unq 0 iso 0 dist 6.64391 10.4495 7.31896 8.08382 5.83399 9.81574 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 7.32002 10.5538 6.1905 11.4838 5.36842 3.93401 numMergedOcc 0
