0 mol 28 unq 0 iso 0 dist 8.40467 9.6867 6.67638 7.431 8.92334 6.31089 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.40467 5.13138 6.29954 7.431 8.92334 7.07502 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 7.24073 6.62196 5.6954 6.51048 8.97167 5.47728 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 7.24073 6.62196 5.6954 4.18951 8.8182 5.39651 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 7.24073 7.61351 5.18775 10.1563 12.7472 8.48468 numMergedOcc 0
5 mol 28 unq 5 iso 0 dist 8.24422 9.6147 8.95481 8.04432 11.8497 8.48468 numMergedOcc 0
6 mol 28 unq 6 iso 0 dist 8.99724 9.6147 13.1923 8.04432 15.6309 8.48468 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 9.25638 9.47519 13.1967 14.0094 18.7689 9.87982 numMergedOcc 0
8 mol 67 unq 1 iso 0 dist 8.01856 9.47519 12.4017 14.0094 15.7437 9.87982 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 5.68894 8.0534 9.94048 10.3098 7.9575 8.59337 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 5.68894 8.0534 9.94048 6.35914 9.53456 7.66942 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.32265 8.0534 6.88106 10.3098 5.88827 8.59337 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 7.32265 8.0534 6.88106 6.35914 9.66175 7.66942 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 4.56886 9.13081 6.32847 7.67738 7.34765 4.48699 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 9.61 9.95533 9.74349 4.60169 7.4121 7.19893 numMergedOcc 0
15 mol 147 unq 1 iso 0 dist 9.61 9.95533 9.74349 9.0113 11.6856 6.37938 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 9.54774 7.27943 13.3124 4.52353 12.1038 5.42715 numMergedOcc 0
17 mol 152 unq 1 iso 0 dist 9.54774 7.27943 13.3124 6.79695 8.52131 9.70575 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 9.15159 5.59924 6.59428 4.63914 8.75986 7.48765 numMergedOcc 0
19 mol 173 unq 0 iso 0 dist 7.57272 9.00002 7.97968 12.3835 14.6497 9.02222 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 6.74526 9.93982 9.79525 14.1041 17.337 9.90699 numMergedOcc 0
21 mol 209 unq 1 iso 0 dist 8.12326 9.93982 7.48645 14.1041 16.5412 9.90699 numMergedOcc 0
22 mol 209 unq 2 iso 0 dist 8.20431 9.9518 7.48645 15.8185 16.5412 9.90699 numMergedOcc 0
23 mol 209 unq 3 iso 0 dist 8.8886 9.9518 3.88024 15.8185 11.2196 9.90699 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 7.79173 9.44207 5.99306 7.57724 12.4086 9.76998 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 8.30313 7.44868 9.69725 9.10431 15.3584 9.18236 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 6.51248 7.44868 5.63803 9.10431 13.1317 9.18236 numMergedOcc 0
