0 mol 4 unq 0 iso 0 dist 9.63758 9.34175 9.12428 5.74287 5.69713 7.66731 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 7.38748 7.15287 6.8464 16.4559 9.5325 15.6193 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 7.38748 7.8893 9.15183 16.4559 9.5325 18.0003 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 8.8795 10.0338 8.44473 6.30619 9.5437 7.91138 numMergedOcc 0
4 mol 66 unq 0 iso 0 dist 8.68658 11.4986 7.3359 9.45863 9.96022 5.55065 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.07498 4.97477 9.04731 12.6035 8.30379 9.66689 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.07498 16.0506 9.85884 12.6035 8.30379 5.1943 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.47045 10.5755 9.04731 10.0142 8.30379 9.66689 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.47045 9.80866 9.85884 10.0142 8.30379 5.1943 numMergedOcc 0
9 mol 105 unq 0 iso 0 dist 6.1083 11.0473 8.67414 12.7631 8.5972 8.22667 numMergedOcc 0
10 mol 105 unq 1 iso 0 dist 6.11833 11.5147 9.94398 6.99759 7.29506 7.33596 numMergedOcc 0
11 mol 105 unq 2 iso 0 dist 7.12201 9.36409 9.94398 8.04843 7.29506 7.33596 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 7.98755 11.6341 8.02366 10.9549 7.89418 9.54173 numMergedOcc 0
13 mol 176 unq 1 iso 0 dist 7.98755 5.17719 8.93118 10.9549 7.89418 7.81832 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.57174 9.18635 9.9693 7.92534 8.19109 5.17382 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 6.80214 14.1934 9.9693 14.2789 8.19109 5.17382 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 8.52996 9.00536 5.90092 7.57563 7.8941 8.46117 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 6.9103 10.2837 7.41931 8.37961 6.92165 8.2372 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 8.63249 10.2557 5.90804 7.05684 5.6241 7.00028 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 7.74348 6.49831 5.90804 10.151 5.6241 7.00028 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.26312 7.05402 7.78671 14.2074 7.07461 10.0165 numMergedOcc 0
21 mol 239 unq 1 iso 0 dist 7.58554 8.27566 7.78671 10.871 7.07461 10.0165 numMergedOcc 0
