0 mol 6 unq 0 iso 0 dist 7.6948 7.46244 7.50895 6.67429 8.31647 7.54484 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.76497 9.83589 7.04837 5.38502 8.6232 7.63222 numMergedOcc 0
2 mol 66 unq 0 iso 0 dist 7.16147 6.32532 3.7783 4.35884 8.68658 7.3084 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.28357 8.18572 5.34337 9.04086 8.7142 10.1328 numMergedOcc 0
4 mol 116 unq 0 iso 0 dist 5.58346 5.93365 5.77115 8.38134 6.53824 10.9455 numMergedOcc 0
5 mol 116 unq 1 iso 0 dist 7.09179 5.93365 9.75449 8.38134 6.61973 10.9455 numMergedOcc 0
6 mol 116 unq 2 iso 0 dist 6.24768 6.99944 5.77115 5.88698 6.53824 10.9455 numMergedOcc 0
7 mol 116 unq 3 iso 0 dist 9.31875 6.99944 9.75449 5.88698 6.61973 10.9455 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 9.20977 9.15119 6.28632 6.84485 9.39389 10.9731 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 9.89646 8.73613 5.84771 12.352 5.32865 10.5204 numMergedOcc 0
10 mol 157 unq 0 iso 0 dist 6.97303 8.51753 7.68025 6.72897 6.8976 10.9016 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 6.23903 9.3066 10.4887 7.14992 8.97652 14.0279 numMergedOcc 0
12 mol 187 unq 0 iso 0 dist 9.383 8.00104 8.06583 6.06679 5.58167 5.7938 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.37024 9.7713 7.9981 5.06545 6.52136 11.8272 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 5.42605 6.2767 7.00744 6.5604 7.26758 12.205 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 8.82741 8.8602 13.1212 7.50159 4.64178 13.0544 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 8.82741 8.8602 13.1212 14.8655 9.16988 21.546 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 6.51561 9.18386 5.90311 5.44638 5.83342 9.24101 numMergedOcc 0
