0 mol 98 unq 0 iso 0 dist 7.91249 9.92781 7.06961 10.8784 9.83528 11.7625 numMergedOcc 0
1 mol 98 unq 1 iso 0 dist 7.91249 9.92781 7.06961 12.9987 7.54969 9.49967 numMergedOcc 0
2 mol 98 unq 2 iso 0 dist 7.94919 6.56349 7.06961 13.9929 9.83528 11.7625 numMergedOcc 0
3 mol 98 unq 3 iso 0 dist 7.94919 6.56349 7.06961 8.65823 7.54969 9.49967 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 6.70974 8.26447 10.1816 10.0476 9.70016 17.7779 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 6.70974 6.71684 8.42718 10.0476 9.70016 15.4081 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 6.68587 8.13828 8.2619 4.52761 5.06555 10.8414 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 5.47457 6.20073 5.81428 7.05275 7.5055 8.91143 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 6.67261 8.46537 10.3792 7.6165 6.28961 8.59976 numMergedOcc 0
9 mol 169 unq 1 iso 0 dist 6.67261 7.05602 8.6888 7.6165 6.28961 9.71763 numMergedOcc 0
10 mol 237 unq 0 iso 0 dist 9.88189 7.13903 12.2098 5.3482 9.59483 12.2727 numMergedOcc 0
11 mol 237 unq 1 iso 0 dist 9.88189 7.13903 12.2098 17.9479 8.42717 18.571 numMergedOcc 0
12 mol 267 unq 0 iso 0 dist 9.1753 6.83507 9.14203 10.0752 7.94474 14.2752 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 8.45131 5.72538 13.2859 6.33623 7.95849 8.25538 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 8.45131 5.72538 13.2859 6.33623 7.95849 8.25538 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 8.45131 5.72538 13.2859 6.33623 7.95849 8.25538 numMergedOcc 0
