0 mol 5 unq 0 iso 0 dist 6.81899 5.7208 9.19117 7.12113 9.17088 5.32128 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.81899 7.89848 9.65106 7.12113 9.17088 12.6053 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 7.67459 6.82158 5.51659 6.30607 9.21978 5.14684 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 7.67459 6.82158 5.51659 9.69698 8.03754 11.2139 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 9.27341 7.18925 6.89622 9.50073 8.41774 10.1755 numMergedOcc 0
5 mol 156 unq 0 iso 0 dist 5.50879 5.79317 9.05763 10.9993 8.50926 10.0275 numMergedOcc 0
6 mol 156 unq 1 iso 0 dist 6.69157 12.442 9.05763 4.75264 8.50926 10.0275 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 7.09439 5.61877 9.58533 5.30941 9.74671 5.28389 numMergedOcc 0
8 mol 209 unq 0 iso 0 dist 6.82209 5.18002 8.21628 5.3114 9.66809 6.06939 numMergedOcc 0
9 mol 212 unq 0 iso 0 dist 7.98724 8.72678 8.99065 6.09177 9.55058 5.50123 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 9.57625 11.6555 7.81237 13.0808 5.39218 4.90657 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 7.449 11.8868 8.45305 5.56089 6.29774 6.72592 numMergedOcc 0
12 mol 239 unq 1 iso 0 dist 7.449 11.8868 8.45305 7.18168 9.28258 12.1268 numMergedOcc 0
13 mol 239 unq 2 iso 0 dist 8.98789 14.9427 8.45305 8.75635 6.29774 6.72592 numMergedOcc 0
14 mol 239 unq 3 iso 0 dist 8.98789 14.9427 8.45305 5.85469 9.28258 12.1268 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 6.2667 13.018 8.92083 8.82711 9.21656 11.9809 numMergedOcc 0
16 mol 248 unq 0 iso 0 dist 7.51278 5.42089 7.72564 6.14956 9.27041 6.2762 numMergedOcc 0
17 mol 248 unq 1 iso 0 dist 7.51278 5.42089 7.72564 5.68749 8.98788 6.12544 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.76302 12.119 9.70022 6.00593 8.41236 7.96313 numMergedOcc 0
19 mol 274 unq 1 iso 0 dist 8.76302 9.94976 7.32898 6.00593 8.41236 7.97998 numMergedOcc 0
20 mol 274 unq 2 iso 0 dist 9.11322 17.2375 9.70022 12.4287 8.41236 7.96313 numMergedOcc 0
21 mol 274 unq 3 iso 0 dist 9.11322 5.44831 7.32898 12.4287 8.41236 7.97998 numMergedOcc 0
22 mol 276 unq 0 iso 0 dist 5.54217 8.00091 8.26741 6.02816 8.15803 5.72513 numMergedOcc 0
