0 mol 7 unq 0 iso 0 dist 8.59288 9.98978 9.33703 5.83293 9.5325 5.05728 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.82037 12.6064 9.64891 8.63915 6.94273 12.6548 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.46289 4.99693 7.96082 4.63984 5.55376 6.2072 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 5.82247 5.05355 7.96082 8.06454 5.55376 6.2072 numMergedOcc 0
4 mol 30 unq 2 iso 0 dist 7.28907 7.25803 7.96082 9.05915 5.55376 6.2072 numMergedOcc 0
5 mol 30 unq 3 iso 0 dist 8.64725 14.4535 7.96082 8.5432 5.55376 6.2072 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 8.64047 11.0215 8.09408 16.1344 9.27584 6.92136 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 7.46327 12.1054 5.89661 12.957 8.16531 6.77664 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 7.46327 12.1054 5.89661 14.6149 8.98593 9.75871 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.04112 7.47861 5.77628 4.75097 8.86754 11.9923 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 8.2866 12.4758 9.85967 7.63153 5.14185 13.1335 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 8.2866 8.60665 9.7578 7.63153 5.14185 11.833 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 6.73307 4.7682 7.90906 4.25603 4.72269 4.72503 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 6.38764 5.11561 7.30969 13.6004 8.19109 13.0184 numMergedOcc 0
14 mol 223 unq 0 iso 0 dist 7.59213 4.88048 8.99964 10.9692 8.51763 10.3216 numMergedOcc 0
15 mol 223 unq 1 iso 0 dist 7.59213 4.88048 8.99964 10.2498 5.57309 9.23845 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 8.31175 7.45625 7.84195 4.51435 9.56438 4.8694 numMergedOcc 0
17 mol 279 unq 1 iso 0 dist 8.31175 13.8886 9.2174 4.51435 9.56438 14.5542 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 9.23821 5.17128 7.50258 12.7706 9.76311 14.5079 numMergedOcc 0
