0 mol 20 unq 0 iso 0 dist 8.45034 9.20585 8.67928 12.5691 6.29237 10.5097 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 8.45034 9.20585 8.67928 16.0182 9.24286 12.7656 numMergedOcc 0
2 mol 31 unq 0 iso 0 dist 9.45832 7.30482 6.19751 6.02138 9.68684 9.18361 numMergedOcc 0
3 mol 31 unq 1 iso 0 dist 9.45832 7.30482 6.19751 3.71798 7.13127 6.97727 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.43487 14.8221 5.9758 13.1684 6.41507 5.42524 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 9.43487 14.8221 5.9758 8.60362 6.03035 8.74879 numMergedOcc 0
6 mol 113 unq 2 iso 0 dist 9.97052 13.6711 5.9758 9.20774 6.41507 5.42524 numMergedOcc 0
7 mol 113 unq 3 iso 0 dist 9.97052 13.6711 5.9758 5.56591 6.03035 8.74879 numMergedOcc 0
8 mol 113 unq 4 iso 0 dist 7.3324 9.69428 5.9758 10.6893 6.41507 5.42524 numMergedOcc 0
9 mol 113 unq 5 iso 0 dist 7.3324 9.69428 5.9758 12.0012 6.03035 8.74879 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 6.29634 4.01593 7.84768 5.92411 4.22806 5.37917 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 4.80778 8.9356 8.966 3.84992 5.47256 6.24625 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 6.58803 6.26174 8.966 5.68827 5.47256 6.24625 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 9.96967 5.53181 8.966 10.124 5.47256 6.24625 numMergedOcc 0
14 mol 133 unq 3 iso 0 dist 6.31523 14.5316 8.966 11.5628 5.47256 6.24625 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.33272 5.18732 7.81069 3.6848 7.54492 4.03697 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 7.03647 11.3186 7.93342 6.04066 6.23614 5.8463 numMergedOcc 0
17 mol 247 unq 0 iso 0 dist 5.89063 4.11384 7.21548 5.92277 6.93227 5.2718 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 7.01175 12.0055 9.60449 4.06041 9.0654 13.146 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 7.50074 15.6957 9.60449 9.59994 9.0654 13.146 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 7.81415 10.5903 7.36223 3.77125 8.47034 11.2019 numMergedOcc 0
21 mol 283 unq 1 iso 0 dist 7.81415 10.5903 7.36223 8.36144 8.57491 5.33386 numMergedOcc 0
