0 mol 4 unq 0 iso 0 dist 6.05231 6.34563 4.83806 9.80438 6.1326 7.02535 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.79863 6.76332 4.8178 7.84963 12.863 11.9461 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.45133 7.2159 12.8622 5.80534 8.78977 5.09775 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 7.45133 8.93093 7.62878 5.80534 8.78977 5.46756 numMergedOcc 0
4 mol 37 unq 0 iso 0 dist 9.77734 8.98177 4.33272 9.03346 7.77749 4.95968 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 8.58588 9.3913 9.84642 8.7531 9.02466 5.47272 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 8.58588 9.3913 9.84642 7.25138 9.92911 12.5032 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.28161 9.99537 7.37399 5.48163 4.5216 4.69684 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 8.55124 7.62629 5.87063 5.10693 7.41642 7.08249 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 8.55124 7.62629 5.87063 6.58814 6.51388 8.37319 numMergedOcc 0
10 mol 93 unq 2 iso 0 dist 8.55124 7.62629 5.87063 6.13459 10.4066 9.47729 numMergedOcc 0
11 mol 93 unq 3 iso 0 dist 8.55124 7.62629 5.87063 7.54391 7.0544 8.88832 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 6.59749 7.31277 5.21599 8.26128 6.64725 4.8443 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.52322 9.71223 4.83829 6.99587 7.93285 5.56574 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 8.52322 9.71223 4.83829 4.37577 8.70013 7.76011 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 9.9224 7.252 7.4314 5.05414 11.3109 9.52346 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 9.9224 7.252 7.4314 7.16964 8.942 6.78691 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 5.53473 6.18894 5.33261 6.61322 6.42446 10.613 numMergedOcc 0
18 mol 269 unq 0 iso 0 dist 5.51844 7.97206 7.92346 6.72096 4.89258 4.41005 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 6.33332 5.27236 5.62438 7.48987 7.0236 4.99494 numMergedOcc 0
20 mol 294 unq 1 iso 0 dist 6.33332 5.27236 5.62438 8.35637 3.65046 9.15036 numMergedOcc 0
