0 mol 34 unq 0 iso 0 dist 6.17472 6.10716 6.40741 11.9866 7.58092 7.37118 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.10175 5.01159 5.7405 9.63616 7.25076 5.27979 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 9.27229 4.96456 8.44181 11.3986 4.7749 8.3479 numMergedOcc 0
3 mol 71 unq 1 iso 0 dist 7.86678 12.8239 8.44181 12.0411 4.7749 8.3479 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.51608 6.20053 6.84747 12.6948 7.1203 8.99536 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.51608 7.70147 7.75436 12.6948 7.1203 5.94317 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 7.93891 4.90088 8.86612 7.75075 6.84152 8.99536 numMergedOcc 0
7 mol 76 unq 3 iso 0 dist 8.62536 4.90088 6.84747 7.75075 7.1203 8.99536 numMergedOcc 0
8 mol 76 unq 4 iso 0 dist 8.62536 7.5659 7.75436 7.75075 7.1203 5.94317 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.87856 4.81103 4.94406 8.73798 11.2684 7.54574 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 6.2491 4.81103 7.2337 8.73798 4.05759 7.54574 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 3.59451 7.22196 7.2337 5.24616 4.05759 7.54574 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 5.61764 4.26006 8.18186 9.66083 8.5036 8.65859 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 8.26291 9.33864 5.05277 8.12319 4.81304 8.00013 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 7.86001 5.6007 5.05277 9.04366 4.81304 8.00013 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 8.51265 13.1683 7.35385 12.2003 4.20944 8.40695 numMergedOcc 0
16 mol 141 unq 1 iso 0 dist 8.51265 13.1683 7.35385 11.2971 6.685 9.35867 numMergedOcc 0
17 mol 141 unq 2 iso 0 dist 8.51265 9.00056 8.35864 11.2971 6.685 9.38036 numMergedOcc 0
18 mol 141 unq 3 iso 0 dist 9.98097 10.537 9.80549 7.43045 4.45608 9.62774 numMergedOcc 0
19 mol 193 unq 0 iso 0 dist 9.16852 5.35985 9.82224 10.8116 3.41036 9.9042 numMergedOcc 0
20 mol 193 unq 1 iso 0 dist 9.16852 12.1335 8.95886 10.8116 3.41036 6.21262 numMergedOcc 0
21 mol 193 unq 2 iso 0 dist 8.6538 9.89855 9.82224 11.1216 3.41036 9.9042 numMergedOcc 0
22 mol 193 unq 3 iso 0 dist 8.6538 13.8215 8.95886 11.1216 3.41036 6.21262 numMergedOcc 0
23 mol 193 unq 4 iso 0 dist 5.19654 12.9817 9.82224 6.10013 3.41036 9.9042 numMergedOcc 0
24 mol 193 unq 5 iso 0 dist 5.19654 10.7013 8.95886 6.10013 3.41036 6.21262 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 7.33708 5.65837 6.67239 10.9832 3.79439 9.89191 numMergedOcc 0
26 mol 232 unq 1 iso 0 dist 4.46314 10.7624 6.67239 4.76819 3.79439 9.89191 numMergedOcc 0
27 mol 253 unq 0 iso 0 dist 9.35766 10.5693 9.6479 15.6678 18.2165 9.82605 numMergedOcc 0
28 mol 253 unq 1 iso 0 dist 9.35766 10.5693 9.6479 14.254 15.9194 9.73723 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 8.16746 6.84952 9.02661 9.76634 9.90818 8.09181 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 6.9719 9.61922 9.7659 15.2764 11.9773 9.01437 numMergedOcc 0
