0 mol 7 unq 0 iso 0 dist 8.8576 8.401 5.99972 10.7344 5.13353 9.68006 4.44694 5.51421 4.60206 7.81271 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.13365 13.3998 7.29868 20.1024 15.5315 8.4051 25.4835 18.501 12.1061 9.54519 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.13365 13.3998 7.29868 17.544 10.0952 8.60554 20.6632 14.4535 11.095 6.11056 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.80849 14.1707 8.60554 17.5377 14.6259 8.4051 12.6046 12.511 12.1061 9.54519 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.80849 9.47767 9.44691 17.5377 14.6259 8.75662 12.6046 12.511 6.81998 9.54519 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 6.00307 6.03478 6.16347 13.1745 10.9391 7.45383 8.65485 8.40051 4.32173 8.6396 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 9.28346 6.51677 7.12365 10.7688 5.34368 8.1284 4.41825 9.44073 5.73417 8.609 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.56664 6.71938 7.56205 9.58156 8.62608 4.74544 11.1016 14.3699 7.46975 8.1599 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 7.99003 5.31715 7.56205 9.89555 8.62608 4.74544 11.1205 14.3699 7.46975 8.1599 numMergedOcc 0
9 mol 62 unq 2 iso 0 dist 9.96382 6.76473 7.56205 7.59416 8.62608 4.74544 7.04908 14.3699 7.46975 8.1599 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 7.59073 5.83497 9.39864 11.7649 10.1164 7.54568 9.59687 11.7434 3.88757 6.58793 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.53153 5.42142 9.97654 6.29975 6.69554 6.66772 7.49664 10.2159 11.5759 9.3894 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 8.29673 5.42142 7.71248 6.29975 7.6656 6.66772 7.49664 14.8299 11.5759 9.3894 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 4.97115 7.68725 6.70531 7.23126 10.2747 6.86319 15.4605 17.0839 11.4857 8.79558 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 7.51923 8.91883 7.75885 7.94694 5.63422 6.16414 16.3384 14.4684 10.9922 9.36079 numMergedOcc 0
15 mol 206 unq 1 iso 0 dist 7.51923 8.91883 7.75885 7.94694 5.63422 6.16414 13.2408 12.7047 8.16827 7.42904 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 6.51823 12.1252 8.67864 10.9573 8.87326 8.94014 8.93191 10.7555 16.2294 9.32451 numMergedOcc 0
