0 mol 10 unq 0 iso 0 dist 8.33546 6.31531 8.63915 4.64029 12.0464 9.29504 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 9.42122 5.25583 6.32851 5.77108 12.1184 6.6051 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 9.42122 5.25583 6.32851 8.27891 13.0992 8.15864 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 6.76604 8.58468 8.23357 9.26114 12.6167 7.34681 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.94728 9.08536 4.71974 16.6438 11.1576 7.69637 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 8.38139 7.99735 5.0573 13.11 10.4777 9.53081 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 5.76314 6.25196 4.11549 6.39129 10.5096 8.16246 numMergedOcc 0
7 mol 54 unq 1 iso 0 dist 5.76314 8.88159 8.12687 6.39129 10.5096 9.48823 numMergedOcc 0
8 mol 64 unq 0 iso 0 dist 9.23164 7.85826 5.04832 7.26196 10.3662 5.66803 numMergedOcc 0
9 mol 64 unq 1 iso 0 dist 9.23164 7.85826 5.04832 7.27834 6.27017 8.85416 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.45085 5.56645 4.69562 9.91621 12.4674 8.53914 numMergedOcc 0
11 mol 116 unq 0 iso 0 dist 8.56629 6.24768 8.52343 5.88698 10.5048 6.53824 numMergedOcc 0
12 mol 116 unq 1 iso 0 dist 8.56629 9.31875 12.1942 5.88698 10.5048 6.61973 numMergedOcc 0
13 mol 116 unq 2 iso 0 dist 7.56091 6.24768 5.93763 5.88698 10.899 6.53824 numMergedOcc 0
14 mol 116 unq 3 iso 0 dist 7.56091 9.31875 10.3148 5.88698 10.899 6.61973 numMergedOcc 0
15 mol 124 unq 0 iso 0 dist 7.24083 8.45451 9.3565 12.0208 14.5193 7.18976 numMergedOcc 0
16 mol 132 unq 0 iso 0 dist 8.78382 9.20977 4.8602 6.84485 5.52837 9.39389 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 8.27008 8.61918 8.09812 13.2228 13.4646 5.79195 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 8.27008 8.61918 8.09812 15.392 8.72732 9.2759 numMergedOcc 0
19 mol 133 unq 2 iso 0 dist 8.27008 8.61918 8.09812 15.6785 14.5023 8.76088 numMergedOcc 0
20 mol 140 unq 0 iso 0 dist 8.15605 9.16949 4.46614 11.7651 12.9378 9.13339 numMergedOcc 0
21 mol 140 unq 1 iso 0 dist 8.15605 9.16949 4.46614 5.14081 8.72216 7.60956 numMergedOcc 0
22 mol 140 unq 2 iso 0 dist 8.15605 8.65294 4.74205 5.14081 8.72216 9.9171 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 9.5174 9.87771 4.15537 15.2194 7.69328 7.83793 numMergedOcc 0
24 mol 280 unq 0 iso 0 dist 9.69573 8.71581 6.22294 9.78493 7.38699 8.83076 numMergedOcc 0
25 mol 280 unq 1 iso 0 dist 9.69573 8.71581 6.22294 7.74111 14.0815 9.76967 numMergedOcc 0
26 mol 280 unq 2 iso 0 dist 6.42515 9.79817 6.22294 9.73214 7.38699 8.83076 numMergedOcc 0
27 mol 280 unq 3 iso 0 dist 6.42515 9.79817 6.22294 13.8226 14.0815 9.76967 numMergedOcc 0
28 mol 280 unq 4 iso 0 dist 9.8581 9.79817 12.9626 9.73214 12.3342 8.83076 numMergedOcc 0
29 mol 280 unq 5 iso 0 dist 9.8581 9.79817 12.9626 13.8226 20.9834 9.76967 numMergedOcc 0
30 mol 281 unq 0 iso 0 dist 9.18565 7.90993 9.69803 11.8486 14.1448 6.58925 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 8.63523 8.90069 4.33731 10.2133 9.23009 9.22572 numMergedOcc 0
