0 mol 48 unq 0 iso 0 dist 8.02004 13.1138 7.87476 13.2196 5.90067 8.92898 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 6.35042 4.67004 7.87476 10.2313 5.90067 8.92898 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 6.89262 11.6207 9.78668 10.3687 6.82593 8.55712 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 6.50646 6.85539 9.78668 7.13638 6.82593 8.55712 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 9.97224 3.30756 9.2934 8.21985 4.86242 9.20861 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 6.77889 5.906 6.94015 11.716 5.53162 9.24546 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.22039 4.40012 7.43587 12.9661 8.51234 9.68074 numMergedOcc 0
7 mol 234 unq 0 iso 0 dist 9.20848 16.7711 9.8226 14.2129 6.14528 5.69634 numMergedOcc 0
8 mol 234 unq 1 iso 0 dist 9.20848 16.7711 9.8226 19.2132 11.1481 7.91374 numMergedOcc 0
9 mol 234 unq 2 iso 0 dist 9.20848 16.7711 9.8226 19.9792 11.0167 7.35086 numMergedOcc 0
10 mol 234 unq 3 iso 0 dist 9.20848 16.7711 9.8226 21.5392 15.0842 6.81195 numMergedOcc 0
11 mol 251 unq 0 iso 0 dist 5.63943 3.46172 6.63516 11.6268 9.18859 9.55854 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 8.13376 3.94409 8.75224 5.68415 11.3446 5.23503 numMergedOcc 0
13 mol 259 unq 1 iso 0 dist 8.13376 3.94409 8.75224 9.6484 11.1732 9.61028 numMergedOcc 0
14 mol 265 unq 0 iso 0 dist 5.14122 3.99477 6.80043 11.0134 10.3184 8.03604 numMergedOcc 0
15 mol 265 unq 1 iso 0 dist 5.14122 3.99477 6.80043 5.88787 4.98228 5.94614 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 7.87939 5.36106 9.92035 6.41474 4.75686 9.50158 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 6.87275 4.32613 7.45915 10.5122 14.8801 9.94661 numMergedOcc 0
18 mol 278 unq 1 iso 0 dist 7.02416 3.64811 7.45915 13.504 14.8801 9.94661 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 5.78449 9.8348 8.91437 14.7073 10.4634 7.83424 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 9.83077 13.986 7.89784 14.9202 7.32101 3.93401 numMergedOcc 0
21 mol 292 unq 1 iso 0 dist 8.45634 11.1761 7.89784 13.3787 7.32101 3.93401 numMergedOcc 0
