0 mol 1 unq 0 iso 0 dist 9.40282 8.93702 5.11735 4.61559 6.4181 7.90928 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.44151 8.71628 12.5816 7.5037 7.11633 14.5111 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.90024 7.84444 12.2025 14.9559 8.38387 19.9689 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.27156 4.89196 5.49555 8.33049 8.1599 8.84323 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 7.96299 6.88603 9.85676 4.5896 7.75811 9.16721 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.96446 9.62702 10.9381 5.27016 8.4545 12.9838 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 9.96446 6.97484 12.1976 5.27016 8.4545 10.5024 numMergedOcc 0
7 mol 92 unq 2 iso 0 dist 6.70686 9.62702 7.17408 5.27016 7.01176 12.9838 numMergedOcc 0
8 mol 92 unq 3 iso 0 dist 6.70686 6.97484 10.944 5.27016 7.01176 10.5024 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 7.42474 6.85365 6.35364 6.92638 7.53905 9.45003 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 5.06555 9.68343 8.94259 8.75149 7.04864 11.1011 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 8.47907 9.55337 5.41882 5.08302 9.40018 10.5999 numMergedOcc 0
12 mol 122 unq 1 iso 0 dist 8.47907 9.55337 5.41882 11.2519 6.78949 11.2796 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 8.3127 9.81998 4.64539 3.56535 8.01677 10.6266 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 8.66715 4.95674 12.0863 13.3005 9.50322 15.0113 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 9.00172 4.95674 9.53782 13.3005 5.82404 15.0113 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 8.95433 9.59094 4.68409 15.4773 9.50322 11.5756 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 6.44195 5.81632 5.83431 5.32921 9.93555 8.46844 numMergedOcc 0
18 mol 154 unq 1 iso 0 dist 7.34207 5.81632 6.53652 9.95968 6.23399 11.937 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 6.53913 9.4422 6.58937 4.88159 5.59806 9.19849 numMergedOcc 0
20 mol 187 unq 0 iso 0 dist 9.38169 9.25105 6.62321 10.2744 9.36086 8.26654 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 6.18446 6.58245 5.2908 10.0696 8.3337 10.7619 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 5.82039 8.65687 4.8585 8.60571 9.78438 9.91294 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 9.79816 7.89694 11.0503 16.0359 7.73315 15.398 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 9.79816 5.66171 7.47048 16.0359 7.73315 12.023 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 6.45574 6.43838 10.6981 9.7911 8.48065 10.648 numMergedOcc 0
26 mol 235 unq 1 iso 0 dist 6.45574 9.24964 9.66021 9.7911 8.48065 14.8164 numMergedOcc 0
27 mol 235 unq 2 iso 0 dist 8.14407 5.71896 9.66021 10.656 8.48065 14.8164 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 7.77765 7.86196 6.17102 6.22911 7.98617 11.886 numMergedOcc 0
