0 mol 26 unq 0 iso 0 dist 9.7522 15.0931 8.34347 17.1125 11.887 9.16962 15.1395 10.8071 4.09495 8.62693 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 6.65344 13.1729 7.71095 10.6421 5.3525 8.24062 12.5606 10.7681 10.8906 8.68726 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 9.72689 13.7794 9.36773 16.3169 6.95868 9.2603 14.8895 7.74197 4.0486 5.82918 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 4.98864 6.59772 6.11741 12.7883 10.8939 7.64585 10.7282 10.8398 5.24961 5.58063 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 7.95871 4.86477 6.11741 10.1292 10.8939 7.64585 6.56935 10.8398 5.24961 5.58063 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 8.90977 13.8755 7.90328 13.2996 4.91401 6.62561 5.70541 6.90827 10.4485 9.58171 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 8.90977 10.6616 7.83136 13.2996 4.91401 7.63616 5.70541 6.90827 5.27151 9.58171 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.44385 12.1192 9.87172 13.4009 7.36192 7.44174 14.4171 13.2232 11.0075 8.95838 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.44385 12.1192 9.87172 13.4009 7.36192 7.44174 21.0407 15.3808 9.93013 9.47892 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 5.63005 10.5268 8.73993 13.4009 10.6679 9.63176 14.4171 13.3689 5.85391 8.95838 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 5.63005 10.5268 8.73993 13.4009 10.6679 9.63176 21.0407 19.5006 18.2257 9.47892 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.84952 4.3158 7.81386 6.17129 6.7991 4.93785 6.7732 10.8641 4.3226 5.83596 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 7.08539 7.38431 5.4638 10.8124 4.65302 8.21247 13.6805 9.11256 6.84447 8.19915 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 9.89665 4.38595 6.84306 10.3034 11.3552 7.17676 15.2125 11.0771 11.2013 6.98151 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 9.89665 11.247 7.68742 10.3034 11.3552 5.34718 15.2125 11.0771 4.15973 6.98151 numMergedOcc 0
15 mol 236 unq 2 iso 0 dist 9.05929 4.38595 8.35971 10.3034 6.40312 7.17676 15.2125 13.3367 11.2013 6.98151 numMergedOcc 0
16 mol 236 unq 3 iso 0 dist 6.11137 15.1664 9.99038 9.91572 6.04825 7.17676 5.26871 5.66569 11.2013 6.98151 numMergedOcc 0
17 mol 236 unq 4 iso 0 dist 6.11137 9.01197 6.27581 9.91572 6.04825 5.34718 5.26871 5.66569 4.15973 6.98151 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.24928 5.33567 6.57393 8.81534 6.20606 5.38637 13.7433 10.6346 13.8985 9.94175 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 9.13537 10.3859 6.57393 17.1186 10.9761 6.91569 21.049 17.949 11.9794 9.88122 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 9.94315 12.521 5.72887 12.9182 13.069 9.29858 5.00891 8.59074 9.18011 9.77231 numMergedOcc 0
21 mol 238 unq 3 iso 0 dist 6.2365 4.7157 5.72887 10.2583 13.069 9.29858 6.21773 8.59074 9.18011 9.77231 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 8.06771 9.79538 7.88519 13.1236 11.6195 7.48005 11.9761 12.348 4.77548 9.53092 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 9.54857 15.3806 7.46176 10.5864 5.79468 7.48005 18.3822 11.6963 4.77548 9.53092 numMergedOcc 0
24 mol 259 unq 2 iso 0 dist 6.42725 8.70769 5.30224 8.65525 5.31048 8.37865 17.4989 12.9189 12.7699 9.53092 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 8.19504 3.93713 6.24356 11.0809 5.12409 9.0012 10.7475 10.7818 11.2529 8.44015 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 8.19504 3.93713 6.24356 11.1852 9.67998 9.5784 10.7475 10.7818 11.2529 6.21206 numMergedOcc 0
