0 mol 54 unq 0 iso 0 dist 9.43268 4.71331 6.77145 11.0797 8.47261 6.43516 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 9.43268 7.70819 4.87397 11.0797 8.47261 7.7205 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 6.24764 11.6877 9.66549 4.45422 5.99046 7.40161 numMergedOcc 0
3 mol 186 unq 0 iso 0 dist 5.54887 6.74368 7.45384 9.60035 7.77211 13.0423 numMergedOcc 0
4 mol 218 unq 0 iso 0 dist 9.56732 6.59965 7.38022 10.0079 8.88206 4.87337 numMergedOcc 0
5 mol 225 unq 0 iso 0 dist 9.21721 13.6874 9.58385 7.50636 8.84033 9.81016 numMergedOcc 0
6 mol 225 unq 1 iso 0 dist 9.21721 14.212 6.83539 7.50636 8.84033 10.6456 numMergedOcc 0
7 mol 225 unq 2 iso 0 dist 9.21721 12.0928 6.22747 7.50636 8.84033 7.43844 numMergedOcc 0
8 mol 225 unq 3 iso 0 dist 9.21721 5.21233 9.21404 7.50636 8.84033 4.32093 numMergedOcc 0
9 mol 271 unq 0 iso 0 dist 5.82864 3.76546 8.74168 5.88597 6.70662 6.15348 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 8.62338 7.99722 8.19213 14.9232 8.58448 8.99712 numMergedOcc 0
11 mol 287 unq 1 iso 0 dist 8.62338 12.9629 5.80664 14.9232 8.58448 4.3442 numMergedOcc 0
12 mol 288 unq 0 iso 0 dist 8.62338 7.99722 8.19213 14.9232 8.58448 8.99712 numMergedOcc 0
13 mol 288 unq 1 iso 0 dist 8.62338 12.9629 5.80664 14.9232 8.58448 4.3442 numMergedOcc 0
14 mol 289 unq 0 iso 0 dist 8.62338 7.99722 8.19213 14.9232 8.58448 8.99712 numMergedOcc 0
15 mol 289 unq 1 iso 0 dist 8.62338 12.9629 5.80664 14.9232 8.58448 4.3442 numMergedOcc 0
16 mol 294 unq 0 iso 0 dist 7.51626 4.10727 8.88961 4.75743 8.83246 7.33654 numMergedOcc 0
