0 mol 24 unq 0 iso 0 dist 8.94703 13.7241 9.03541 6.58064 8.69288 14.3235 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.94703 13.7241 9.03541 6.40447 7.77964 10.5945 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.27137 5.89178 9.94577 10.1908 7.44277 12.0204 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 5.40748 7.88793 9.31516 6.65221 5.40489 10.8961 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.63973 15.9053 9.3711 12.8806 9.08825 12.2676 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.58743 9.0655 8.0318 3.80156 8.51259 6.2804 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 5.82945 6.44931 6.98077 9.25976 7.5573 10.3696 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 9.18289 9.45075 7.7734 5.33968 5.67168 5.21837 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 9.18289 9.45075 7.7734 10.1509 7.74579 5.52154 numMergedOcc 0
9 mol 186 unq 2 iso 0 dist 9.18289 9.45075 7.7734 10.9974 5.86483 7.51045 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 8.60546 6.64858 9.75756 3.7157 8.22795 9.26568 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 6.90791 9.04527 9.68213 5.37149 6.69042 12.4844 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.69512 14.2869 8.71347 3.50446 6.40171 12.4426 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.79378 4.58247 5.83021 9.39446 9.95026 5.84459 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 8.79378 4.58247 5.83021 6.98142 9.09594 4.25315 numMergedOcc 0
15 mol 206 unq 2 iso 0 dist 8.79378 9.70849 9.18711 9.39446 9.95026 7.76853 numMergedOcc 0
16 mol 206 unq 3 iso 0 dist 8.79378 9.70849 9.18711 6.98142 9.09594 4.89614 numMergedOcc 0
17 mol 207 unq 0 iso 0 dist 6.50724 9.63971 6.06003 6.29106 4.76113 4.43093 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 9.49163 6.31615 9.0735 12.7552 9.3502 7.30721 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 9.49163 6.31615 9.0735 5.69755 9.34821 5.22792 numMergedOcc 0
20 mol 225 unq 2 iso 0 dist 9.49163 6.31615 9.0735 12.7092 6.46405 10.0058 numMergedOcc 0
21 mol 225 unq 3 iso 0 dist 9.99149 7.70265 9.0735 14.0407 9.3502 7.30721 numMergedOcc 0
22 mol 225 unq 4 iso 0 dist 9.99149 7.70265 9.0735 3.90755 9.34821 5.22792 numMergedOcc 0
23 mol 225 unq 5 iso 0 dist 9.99149 7.70265 9.0735 11.662 6.46405 10.0058 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 6.96382 15.2081 8.28643 3.68226 4.66186 12.4194 numMergedOcc 0
25 mol 273 unq 0 iso 0 dist 8.89714 12.565 5.63226 12.2057 9.02537 5.35498 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 7.78796 12.3343 6.79765 7.45665 6.22943 6.37045 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 7.78796 12.3343 6.79765 7.02045 9.31056 11.9688 numMergedOcc 0
