0 mol 8 unq 0 iso 0 dist 6.27477 9.69819 10.3253 7.55301 8.99126 16.9132 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.15677 9.53735 10.797 15.7188 6.73162 14.2674 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.61029 9.34599 10.797 7.95969 6.73162 14.2674 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 9.61029 6.32127 10.9837 7.95969 6.73162 12.2621 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 8.28463 6.75307 6.65855 3.71754 9.77484 8.71752 numMergedOcc 0
5 mol 27 unq 1 iso 0 dist 8.28463 7.24775 14.3929 3.71754 9.77484 7.60283 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 7.51978 5.0478 4.29856 5.59128 5.02241 6.30987 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 8.52969 9.42188 9.11373 12.9126 8.26899 16.1794 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.28737 6.25276 4.3931 8.66353 8.97793 10.8997 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 8.28737 6.25276 4.3931 12.2209 8.19682 11.4594 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 5.09688 8.22984 9.75737 10.6273 8.72704 14.4265 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 9.91446 6.6157 7.16919 7.39527 4.76815 7.09065 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 9.26343 6.6157 9.75737 11.6898 8.72704 14.4265 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 9.69757 8.74658 8.23791 12.4356 8.6243 11.4282 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 4.93035 9.14007 7.42649 6.70767 6.93652 5.26989 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 6.96824 5.6688 6.29863 5.54495 6.93764 9.93639 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 9.25528 5.6688 5.6044 14.3955 6.94688 10.3766 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 9.25528 5.6688 5.6044 15.6271 6.71012 10.7723 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 7.8621 8.04856 9.81003 13.0784 6.73313 16.5308 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 7.92766 6.21588 5.86489 13.2566 5.90931 11.641 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 9.06306 8.53661 15.1193 6.32328 8.45368 13.5848 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 6.18486 5.87056 9.32448 5.31715 8.83563 10.4957 numMergedOcc 0
22 mol 227 unq 1 iso 0 dist 6.18486 9.84311 6.48027 5.31715 8.83563 13.792 numMergedOcc 0
23 mol 227 unq 2 iso 0 dist 6.18486 8.85568 6.67321 5.31715 8.83563 9.28891 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 9.29203 8.03226 10.3871 11.091 9.90142 10.6749 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 7.62771 8.03226 6.54814 12.4266 9.68513 14.4678 numMergedOcc 0
26 mol 238 unq 2 iso 0 dist 7.62771 8.03226 6.54814 11.091 5.9216 10.6749 numMergedOcc 0
27 mol 238 unq 3 iso 0 dist 7.80166 8.03226 14.388 12.4266 9.29858 14.4678 numMergedOcc 0
28 mol 250 unq 0 iso 0 dist 6.18342 9.5174 10.8792 6.49019 8.80086 10.8727 numMergedOcc 0
29 mol 253 unq 0 iso 0 dist 5.76077 7.06589 5.78064 10.6548 7.19465 9.58354 numMergedOcc 0
30 mol 253 unq 1 iso 0 dist 7.0247 8.70383 5.78064 3.494 7.19465 9.58354 numMergedOcc 0
31 mol 282 unq 0 iso 0 dist 7.90792 5.94224 6.6348 6.63358 7.32347 6.8972 numMergedOcc 0
32 mol 293 unq 0 iso 0 dist 8.90008 8.60282 5.46037 11.8919 8.56847 10.8485 numMergedOcc 0
