0 mol 11 unq 0 iso 0 dist 9.07476 6.65725 4.79838 5.23547 9.89425 9.58844 9.46202 6.83186 3.56133 12.0683 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 6.46582 13.2281 8.90522 11.3491 9.57759 5.19248 9.68005 7.66068 10.865 9.50354 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 6.46582 13.2281 8.90522 11.3491 9.57759 5.19248 14.6547 9.5043 10.2651 12.0331 numMergedOcc 0
3 mol 76 unq 2 iso 0 dist 6.46582 13.2281 8.90522 11.3491 9.57759 5.19248 14.1202 8.34132 5.92868 9.2434 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 6.67863 9.59696 8.35515 13.2642 9.33112 9.00107 9.54415 8.19144 11.7377 7.5541 numMergedOcc 0
5 mol 204 unq 0 iso 0 dist 9.12524 5.43506 7.76863 9.69119 8.23717 9.11693 5.8523 8.32259 3.99343 5.80328 numMergedOcc 0
6 mol 204 unq 1 iso 0 dist 9.12524 5.43506 7.76863 9.69119 8.23717 9.11693 10.6525 8.54737 11.4601 3.68217 numMergedOcc 0
7 mol 254 unq 0 iso 0 dist 7.89302 5.11145 6.59989 5.06168 5.6417 5.91806 5.81468 7.85841 4.84855 8.8967 numMergedOcc 0
8 mol 254 unq 1 iso 0 dist 7.89302 5.11145 6.59989 5.06168 5.6417 5.91806 8.51317 9.20109 5.67608 10.929 numMergedOcc 0
9 mol 254 unq 2 iso 0 dist 7.89302 5.11145 6.59989 6.25965 7.42831 5.04088 5.81468 7.85841 4.84855 9.42679 numMergedOcc 0
10 mol 254 unq 3 iso 0 dist 7.89302 5.11145 6.59989 6.25965 7.42831 5.04088 8.51317 9.20109 5.67608 10.706 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 9.46576 14.2669 8.8385 17.1277 9.73217 12.2431 3.48905 8.62655 11.4575 15.6308 numMergedOcc 0
12 mol 260 unq 1 iso 0 dist 9.46576 14.2669 8.8385 6.73886 7.49606 12.1038 3.48905 8.62655 11.4575 7.35802 numMergedOcc 0
13 mol 260 unq 2 iso 0 dist 9.46576 14.2669 8.8385 11.1586 8.06377 9.42988 3.48905 8.62655 11.4575 10.4054 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.35293 15.3423 9.6721 10.858 8.20376 17.5987 7.2339 6.96692 16.2268 3.68488 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 9.35293 15.3423 9.6721 10.858 8.20376 17.5987 12.15 8.25286 16.7453 3.14784 numMergedOcc 0
16 mol 266 unq 2 iso 0 dist 9.35293 15.3423 9.6721 10.858 8.20376 17.5987 14.8334 9.9965 17.4207 5.95721 numMergedOcc 0
17 mol 266 unq 3 iso 0 dist 7.93375 15.8824 9.6721 7.54309 8.20376 17.5987 3.87565 6.96692 16.2268 3.68488 numMergedOcc 0
18 mol 266 unq 4 iso 0 dist 7.93375 15.8824 9.6721 7.54309 8.20376 17.5987 9.25882 8.25286 16.7453 3.14784 numMergedOcc 0
19 mol 266 unq 5 iso 0 dist 7.93375 15.8824 9.6721 7.54309 8.20376 17.5987 12.1357 9.9965 17.4207 5.95721 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.40443 13.4432 7.1388 8.85995 8.32982 6.79087 9.94473 6.24487 7.45064 5.55422 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.40443 13.4432 7.1388 8.85995 8.32982 6.79087 9.94473 6.24487 7.45064 5.55422 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 9.40443 13.4432 7.1388 8.85995 8.32982 6.79087 9.94473 6.24487 7.45064 5.55422 numMergedOcc 0
