0 mol 7 unq 0 iso 0 dist 7.15434 8.75346 9.67164 11.9621 12.2041 5.99459 13.7354 10.5461 6.88805 8.41585 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 7.3795 4.67793 7.62333 6.4754 6.23795 9.01112 7.06064 12.4058 7.12261 9.62879 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.28033 6.64634 7.65889 12.3978 10.2656 6.42835 11.5215 11.6856 5.01101 5.05803 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.17086 4.9903 6.6263 10.615 8.13395 6.75943 7.74524 10.5523 4.96926 5.73819 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.17086 4.9903 6.6263 10.615 8.13395 6.75943 5.90113 8.80331 5.41726 6.20293 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 9.17086 4.9903 6.6263 10.615 8.13395 6.75943 10.5661 14.7803 10.0383 8.93915 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 6.68311 8.89611 7.12321 10.1663 8.24309 6.21799 15.0607 9.96708 7.47371 9.78528 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 9.96602 9.64805 9.56773 10.1663 5.8486 5.03251 15.0607 15.1902 9.67587 9.78528 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.124 15.2252 7.4369 10.1112 5.4148 9.73086 13.4367 6.19304 5.70116 9.96396 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.124 15.2252 7.4369 10.1112 5.4148 9.73086 5.33851 10.2049 17.4121 9.38498 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 8.124 15.2252 7.4369 10.1112 5.4148 9.73086 15.7164 11.6369 14.844 9.75218 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 8.22596 13.0711 9.21662 17.8768 10.8375 8.91882 12.6449 10.1489 4.03277 9.60661 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 8.22596 13.0711 9.21662 17.8768 10.8375 8.91882 17.9195 13.2001 6.23008 6.65086 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 8.97043 7.34308 6.39384 12.9647 7.69052 9.42082 16.4507 13.8473 15.3161 7.30858 numMergedOcc 0
14 mol 115 unq 1 iso 0 dist 8.97043 7.34308 6.39384 12.9647 7.69052 9.42082 11.8721 9.33865 6.63111 5.83991 numMergedOcc 0
15 mol 115 unq 2 iso 0 dist 8.97043 7.34308 6.39384 12.9647 7.69052 9.42082 5.19652 6.11741 6.07067 7.88312 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 8.62648 12.6962 7.64052 17.5132 9.93257 8.95212 15.3885 9.72413 4.39676 6.18601 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 8.62648 12.6962 7.64052 11.5266 4.85907 6.99446 16.3727 12.6489 6.20019 9.87172 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 9.79004 5.37122 8.26547 8.43069 5.61668 9.05342 7.33132 8.22656 4.88025 6.82262 numMergedOcc 0
19 mol 133 unq 1 iso 0 dist 8.43069 5.37122 9.05342 9.79004 5.61668 8.26547 10.0277 10.2995 5.03174 7.24514 numMergedOcc 0
20 mol 133 unq 2 iso 0 dist 8.43069 5.37122 9.05342 9.79004 5.61668 8.26547 7.33132 6.82262 4.88025 8.22656 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 7.27598 12.487 7.93372 12.3933 5.49782 7.21868 6.50005 6.37586 8.06642 8.94367 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 7.27598 12.487 7.93372 12.3933 5.49782 7.21868 12.0971 9.71307 4.00092 9.86662 numMergedOcc 0
23 mol 142 unq 0 iso 0 dist 9.14908 9.15345 6.14151 10.9228 5.32922 7.81207 6.3846 5.31024 4.67662 9.2313 numMergedOcc 0
24 mol 142 unq 1 iso 0 dist 9.14908 9.15345 6.14151 10.9228 5.32922 7.81207 4.39297 7.26382 5.81599 7.73169 numMergedOcc 0
25 mol 142 unq 2 iso 0 dist 9.14908 9.15345 6.14151 10.9228 5.32922 7.81207 7.34484 11.0824 11.1 8.96657 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 6.58792 11.9701 8.59874 8.90247 6.01247 9.76212 5.114 9.94371 12.9532 9.1374 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 6.58792 11.9701 8.59874 8.90247 6.01247 9.76212 14.0828 10.9639 6.50233 8.03334 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 9.18245 5.68795 5.05973 13.2054 11.5866 9.01624 9.04896 9.81747 5.71898 7.81386 numMergedOcc 0
29 mol 181 unq 3 iso 0 dist 9.18245 5.68795 5.05973 13.2054 11.5866 9.01624 7.40358 9.11469 5.93724 7.63312 numMergedOcc 0
30 mol 227 unq 0 iso 0 dist 9.60159 5.19262 5.23634 12.0857 5.22356 6.91318 7.51316 7.22101 5.0317 8.65997 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 9.38753 12.2802 6.99888 19.0401 10.1813 9.08509 19.5046 11.0896 12.7938 6.22714 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 9.38753 12.2802 6.99888 19.0401 10.1813 9.08509 18.5369 11.5794 11.0772 7.31233 numMergedOcc 0
33 mol 238 unq 2 iso 0 dist 7.64276 4.48114 9.12776 13.6759 15.7907 9.72188 10.1036 14.6111 7.06793 5.72887 numMergedOcc 0
