0 mol 5 unq 0 iso 0 dist 5.2392 4.42081 9.22027 3.67097 7.50453 3.14155 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.44029 6.38154 4.98321 11.6519 7.74636 6.98653 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 6.50444 6.23648 7.14537 3.5691 6.77807 4.68389 numMergedOcc 0
3 mol 10 unq 1 iso 0 dist 6.50444 4.87706 9.39486 3.5691 6.77807 7.73435 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.94703 6.58064 8.69288 11.0715 8.85286 5.69207 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.94703 6.40447 7.77964 11.0715 8.85286 5.49307 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 9.81143 12.188 7.01952 5.85133 9.41098 14.0196 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 5.40748 6.65221 5.40489 10.3937 9.32314 9.49077 numMergedOcc 0
8 mol 59 unq 0 iso 0 dist 9.01601 11.4478 8.66724 12.2062 6.23509 7.21298 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.762 10.8441 8.46627 8.22845 4.27766 10.0644 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 9.762 15.2203 9.22208 8.22845 4.27766 12.1501 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 6.63973 12.8806 9.08825 9.68005 5.45099 5.16522 numMergedOcc 0
12 mol 76 unq 1 iso 0 dist 6.63973 12.8806 9.08825 14.6547 8.44765 9.60553 numMergedOcc 0
13 mol 76 unq 2 iso 0 dist 6.63973 12.8806 9.08825 14.1202 9.06643 12.9855 numMergedOcc 0
14 mol 79 unq 0 iso 0 dist 7.58743 3.80156 8.51259 5.73969 9.21761 3.07021 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 8.27396 6.60692 4.61596 9.10254 5.23187 3.74437 numMergedOcc 0
16 mol 207 unq 0 iso 0 dist 6.50724 6.29106 4.76113 3.55384 7.30153 4.67727 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 5.76164 4.98419 9.01338 4.45501 8.4338 8.6503 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 9.13546 3.63202 9.78237 14.0586 9.87744 16.216 numMergedOcc 0
19 mol 264 unq 1 iso 0 dist 7.19658 13.3131 9.78237 5.51231 9.87744 16.216 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 7.37488 6.32559 5.02349 9.14234 7.90632 3.36713 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 7.37488 4.53305 9.19322 9.14234 7.90632 10.4717 numMergedOcc 0
22 mol 279 unq 2 iso 0 dist 8.7503 7.93887 5.02349 8.56235 7.90632 3.36713 numMergedOcc 0
23 mol 279 unq 3 iso 0 dist 8.7503 9.84272 9.19322 8.56235 7.90632 10.4717 numMergedOcc 0
