0 mol 34 unq 0 iso 0 dist 7.77613 4.61111 7.68019 7.32472 5.29955 4.75881 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.9175 8.42234 6.77802 9.80453 3.42062 9.05737 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.75432 3.89181 7.49792 5.23167 3.70802 4.46067 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.45469 3.89181 6.58981 5.23167 3.66673 4.46067 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 7.63855 5.4275 6.51901 6.0827 4.29679 4.46067 numMergedOcc 0
5 mol 62 unq 3 iso 0 dist 5.48766 5.4275 9.1926 6.0827 8.07308 4.46067 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 6.24764 10.8634 8.15861 7.61514 3.81285 6.67137 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 6.24764 10.8634 8.15861 8.21116 6.17121 7.04244 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 6.24764 11.7351 9.27814 15.524 11.9486 4.18248 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 9.25793 4.3421 6.77993 7.30934 3.79142 5.24346 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 7.04155 7.0652 8.92653 10.7186 8.70619 5.20429 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 7.04155 7.0652 8.92653 6.06155 3.89959 8.71366 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 7.06005 4.03856 9.40603 6.32254 3.75017 8.65645 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 9.21721 8.58432 5.65735 6.15671 6.46348 9.54529 numMergedOcc 0
14 mol 281 unq 0 iso 0 dist 9.79394 16.2332 7.43535 8.78416 3.86368 7.90368 numMergedOcc 0
15 mol 281 unq 1 iso 0 dist 6.52115 12.9503 7.43535 7.82358 3.86368 7.90368 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.59505 5.28038 8.4625 9.96328 11.4589 4.68668 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 8.62338 7.52677 8.15636 10.8476 11.4888 6.24487 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.59505 5.28038 8.4625 9.96328 11.4589 4.68668 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 8.62338 7.52677 8.15636 10.8476 11.4888 6.24487 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.59505 5.28038 8.4625 9.96328 11.4589 4.68668 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 8.62338 7.52677 8.15636 10.8476 11.4888 6.24487 numMergedOcc 0
