0 mol 7 unq 0 iso 0 dist 9.24412 11.4173 9.96415 10.5596 14.6751 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.24412 11.4173 9.96415 12.6815 7.15287 5.99459 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.1895 11.3011 7.69222 13.2198 6.97502 6.45841 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.1895 12.1586 5.82056 13.0591 4.30874 5.5087 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 9.1895 12.1586 5.82056 13.2198 6.97502 5.61588 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 9.1895 17.1183 9.09115 13.0591 4.30874 6.08682 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 9.1895 17.1183 9.09115 13.2198 6.97502 7.83244 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 4.65445 6.69364 7.69222 7.27994 6.97502 6.45841 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 4.65445 7.01672 5.82056 8.58763 4.30874 5.5087 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 4.65445 7.01672 5.82056 7.27994 6.97502 5.61588 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 4.65445 11.8328 9.09115 8.58763 4.30874 6.08682 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 4.65445 11.8328 9.09115 7.27994 6.97502 7.83244 numMergedOcc 0
12 mol 73 unq 10 iso 0 dist 9.5546 14.1944 7.69222 13.7402 6.97502 6.45841 numMergedOcc 0
13 mol 73 unq 11 iso 0 dist 9.5546 11.048 5.82056 5.9925 4.30874 5.5087 numMergedOcc 0
14 mol 73 unq 12 iso 0 dist 9.5546 11.048 5.82056 13.7402 6.97502 5.61588 numMergedOcc 0
15 mol 73 unq 13 iso 0 dist 9.5546 9.48562 9.09115 5.9925 4.30874 6.08682 numMergedOcc 0
16 mol 73 unq 14 iso 0 dist 9.5546 9.48562 9.09115 13.7402 6.97502 7.83244 numMergedOcc 0
17 mol 98 unq 0 iso 0 dist 7.3603 4.20983 6.84952 7.21175 5.82029 7.02507 numMergedOcc 0
18 mol 98 unq 1 iso 0 dist 7.72065 4.51952 6.84952 10.5943 5.82029 7.02507 numMergedOcc 0
19 mol 144 unq 0 iso 0 dist 6.16363 3.73897 9.08956 7.08779 9.4361 7.64028 numMergedOcc 0
20 mol 146 unq 0 iso 0 dist 9.40282 6.00452 5.50187 11.1658 12.8565 9.04757 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 9.06772 5.11713 9.63224 10.7537 6.34098 9.78634 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 9.06772 9.19127 6.98794 10.7537 6.34098 5.64942 numMergedOcc 0
23 mol 192 unq 2 iso 0 dist 9.06772 9.19127 6.98794 15.3153 9.57246 6.97962 numMergedOcc 0
24 mol 251 unq 0 iso 0 dist 7.64443 13.0342 8.07576 17.0406 9.52592 9.82601 numMergedOcc 0
25 mol 251 unq 1 iso 0 dist 7.64443 13.0342 8.07576 14.0618 7.54315 6.50357 numMergedOcc 0
26 mol 272 unq 0 iso 0 dist 8.19471 3.87541 5.38409 7.22413 4.78295 6.44147 numMergedOcc 0
27 mol 272 unq 1 iso 0 dist 4.98404 3.87541 8.45524 7.22413 8.26567 6.44147 numMergedOcc 0
28 mol 273 unq 0 iso 0 dist 9.15342 14.5112 6.95569 18.4077 11.0966 6.31969 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 6.00002 15.5601 9.91103 21.8187 16.3552 9.57499 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 6.00002 15.5601 9.91103 16.3665 10.4297 5.46926 numMergedOcc 0
31 mol 277 unq 2 iso 0 dist 6.00002 15.5601 9.91103 10.6475 5.77904 8.9682 numMergedOcc 0
32 mol 277 unq 3 iso 0 dist 6.00002 12.9203 7.0603 16.3665 10.4297 5.13913 numMergedOcc 0
33 mol 277 unq 4 iso 0 dist 6.00002 12.9203 7.0603 10.6475 5.77904 6.92711 numMergedOcc 0
34 mol 277 unq 5 iso 0 dist 8.1715 14.7919 9.91103 17.1137 16.3552 9.57499 numMergedOcc 0
35 mol 277 unq 6 iso 0 dist 8.1715 14.7919 9.91103 14.089 10.4297 5.46926 numMergedOcc 0
36 mol 277 unq 7 iso 0 dist 8.1715 14.7919 9.91103 7.144 5.77904 8.9682 numMergedOcc 0
37 mol 277 unq 8 iso 0 dist 8.1715 12.996 7.0603 14.089 10.4297 5.13913 numMergedOcc 0
38 mol 277 unq 9 iso 0 dist 8.1715 12.996 7.0603 7.144 5.77904 6.92711 numMergedOcc 0
39 mol 285 unq 0 iso 0 dist 6.71883 10.2133 6.24134 14.5291 9.237 7.80862 numMergedOcc 0
