0 mol 9 unq 0 iso 0 dist 8.71894 12.8905 8.15337 13.0816 11.0253 6.59312 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.14653 14.4187 8.90935 11.3061 3.69138 8.69709 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 7.01149 6.10172 6.89022 11.8816 8.89627 8.75957 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.12746 3.36265 6.28905 11.6675 10.4286 9.09425 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 7.10895 8.91067 9.33968 8.60716 6.56032 8.61893 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 9.43033 5.04406 8.20345 12.55 5.25923 9.42762 numMergedOcc 0
6 mol 123 unq 1 iso 0 dist 9.43033 8.75597 5.38148 12.55 5.25923 7.30244 numMergedOcc 0
7 mol 123 unq 2 iso 0 dist 8.57379 7.36026 6.63094 13.1867 11.8191 7.30244 numMergedOcc 0
8 mol 123 unq 3 iso 0 dist 5.87154 6.45068 8.24171 11.063 9.04448 7.30244 numMergedOcc 0
9 mol 123 unq 4 iso 0 dist 6.82663 6.45068 6.63094 11.063 11.8191 7.30244 numMergedOcc 0
10 mol 123 unq 5 iso 0 dist 9.93167 7.09872 8.20345 11.7765 5.25923 9.42762 numMergedOcc 0
11 mol 123 unq 6 iso 0 dist 9.93167 6.36283 5.38148 11.7765 5.25923 7.30244 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 8.94535 10.7769 8.94198 6.67699 3.68546 6.14222 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 9.32681 7.03845 6.12608 11.3273 11.7543 6.23115 numMergedOcc 0
14 mol 278 unq 0 iso 0 dist 6.95272 5.55931 9.68335 8.60481 7.27472 7.1656 numMergedOcc 0
15 mol 286 unq 0 iso 0 dist 6.57496 8.51361 6.87255 7.97593 3.82706 9.21276 numMergedOcc 0
16 mol 286 unq 1 iso 0 dist 7.9554 10.1725 6.87255 10.3754 3.82706 9.21276 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.86603 10.0544 8.70479 5.62568 5.41757 7.99204 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 7.17626 6.23875 8.70479 8.82948 5.41757 7.99204 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.86603 10.0544 8.70479 5.62568 5.41757 7.99204 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.17626 6.23875 8.70479 8.82948 5.41757 7.99204 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.86603 10.0544 8.70479 5.62568 5.41757 7.99204 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.17626 6.23875 8.70479 8.82948 5.41757 7.99204 numMergedOcc 0
