0 mol 15 unq 0 iso 0 dist 7.70482 9.04489 5.68079 10.8449 7.42909 5.70754 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 8.17492 6.63195 6.89855 12.5045 4.44905 9.54314 numMergedOcc 0
2 mol 63 unq 1 iso 0 dist 7.10403 11.1855 7.85738 13.184 6.25029 9.54314 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 7.67696 10.8259 7.17133 16.8464 14.8167 9.56859 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 7.67696 10.8259 7.17133 14.7723 12.8471 5.75135 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 7.98124 6.02019 8.86094 5.59846 3.8048 8.56269 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 8.54948 9.17488 5.6516 5.59846 5.53481 9.40699 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 7.28273 3.50174 4.4077 11.2697 5.0466 7.84813 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.13344 4.88335 6.67937 5.59311 13.3296 8.22722 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 8.13344 4.88335 6.67937 5.7232 6.49614 8.52036 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 9.24242 10.5042 8.8756 18.1647 12.5252 9.09554 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 6.74185 8.44347 8.8756 9.84843 12.5252 9.09554 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 8.43359 9.77872 5.5223 13.6927 8.19854 5.05414 numMergedOcc 0
13 mol 192 unq 1 iso 0 dist 8.43359 8.01902 8.00501 13.6927 8.19854 7.16964 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 7.74406 9.66099 9.46274 17.3409 17.6762 9.68612 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 5.79204 5.74821 6.33954 9.28208 6.14114 7.40498 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.64715 4.53368 6.25845 10.0327 5.27724 6.16127 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 9.04355 4.12505 9.31611 7.90634 5.66584 6.16127 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 8.50508 4.12505 6.25845 7.90634 5.27724 6.16127 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.64715 4.53368 6.25845 10.0327 5.27724 6.16127 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 9.04355 4.12505 9.31611 7.90634 5.66584 6.16127 numMergedOcc 0
21 mol 288 unq 2 iso 0 dist 8.50508 4.12505 6.25845 7.90634 5.27724 6.16127 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 7.64715 4.53368 6.25845 10.0327 5.27724 6.16127 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 9.04355 4.12505 9.31611 7.90634 5.66584 6.16127 numMergedOcc 0
24 mol 289 unq 2 iso 0 dist 8.50508 4.12505 6.25845 7.90634 5.27724 6.16127 numMergedOcc 0
