0 mol 10 unq 0 iso 0 dist 6.05338 4.84364 6.50154 8.16906 4.27432 8.7908 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 9.38546 9.08341 5.34723 11.8649 5.64409 9.2087 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.72467 7.65753 9.56614 10.5563 9.78639 4.75881 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 6.78264 10.5685 7.02387 12.0466 6.14049 5.54472 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 6.78264 10.5685 7.02387 14.9397 8.31625 8.62369 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 6.78264 10.5685 7.02387 14.7399 10.1271 6.5241 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 8.80334 5.39197 8.44353 5.43913 5.67204 8.65524 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 8.80334 5.39197 8.44353 8.26877 4.28224 8.22812 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 8.80334 9.53255 6.11249 5.43913 5.67204 8.96151 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 8.80334 9.53255 6.11249 8.26877 4.28224 4.22002 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 8.80334 7.75132 7.86326 5.43913 5.67204 9.02535 numMergedOcc 0
11 mol 48 unq 8 iso 0 dist 8.80334 7.75132 7.86326 8.26877 4.28224 5.77855 numMergedOcc 0
12 mol 48 unq 9 iso 0 dist 8.80334 12.4977 4.74786 15.7674 7.13338 5.54472 numMergedOcc 0
13 mol 48 unq 10 iso 0 dist 8.80334 12.4977 4.74786 16.3703 8.64653 8.62369 numMergedOcc 0
14 mol 48 unq 11 iso 0 dist 8.80334 12.4977 4.74786 8.26877 4.28224 6.5241 numMergedOcc 0
15 mol 48 unq 12 iso 0 dist 9.10314 6.60964 7.03832 13.4577 5.59994 8.65524 numMergedOcc 0
16 mol 48 unq 13 iso 0 dist 9.10314 6.60964 7.03832 12.3213 7.78417 8.96151 numMergedOcc 0
17 mol 48 unq 14 iso 0 dist 9.10314 6.60964 7.03832 12.3093 5.47187 9.02535 numMergedOcc 0
18 mol 48 unq 15 iso 0 dist 9.10314 8.54787 7.16443 13.4577 5.59994 8.22812 numMergedOcc 0
19 mol 48 unq 16 iso 0 dist 9.10314 8.54787 7.16443 12.3213 7.78417 4.22002 numMergedOcc 0
20 mol 48 unq 17 iso 0 dist 9.10314 8.54787 7.16443 12.3093 5.47187 5.77855 numMergedOcc 0
21 mol 48 unq 18 iso 0 dist 9.10314 8.54787 7.16443 16.1929 12.2824 8.10774 numMergedOcc 0
22 mol 48 unq 19 iso 0 dist 9.10314 8.54787 7.16443 14.683 12.3016 6.5241 numMergedOcc 0
23 mol 48 unq 20 iso 0 dist 8.45484 11.8742 4.53565 15.2873 7.08546 5.37439 numMergedOcc 0
24 mol 48 unq 21 iso 0 dist 8.45484 11.8742 4.53565 16.0126 8.61607 8.3714 numMergedOcc 0
25 mol 48 unq 22 iso 0 dist 8.45484 11.8742 4.53565 7.49794 4.12075 6.36817 numMergedOcc 0
26 mol 48 unq 23 iso 0 dist 8.45484 5.44298 8.53722 7.49794 4.12075 8.0812 numMergedOcc 0
27 mol 48 unq 24 iso 0 dist 8.45484 9.10301 6.15814 7.49794 4.12075 4.17933 numMergedOcc 0
28 mol 48 unq 25 iso 0 dist 8.45484 7.24268 7.70284 7.49794 4.12075 5.54893 numMergedOcc 0
29 mol 101 unq 0 iso 0 dist 7.43143 4.4529 8.35515 12.1836 11.7377 8.19144 numMergedOcc 0
30 mol 143 unq 0 iso 0 dist 8.22353 11.9534 8.08798 9.99012 4.19541 4.3855 numMergedOcc 0
31 mol 143 unq 1 iso 0 dist 8.57285 5.08025 8.08798 5.33772 4.19541 4.3855 numMergedOcc 0
32 mol 214 unq 0 iso 0 dist 6.96139 6.49466 7.72298 10.3757 6.05252 7.96338 numMergedOcc 0
33 mol 214 unq 1 iso 0 dist 6.96139 6.49466 7.72298 9.53899 4.00138 7.42759 numMergedOcc 0
34 mol 254 unq 0 iso 0 dist 9.84153 5.22702 6.59989 11.3746 4.84855 7.85841 numMergedOcc 0
35 mol 254 unq 1 iso 0 dist 9.84153 5.22702 6.59989 11.3743 5.67608 9.20109 numMergedOcc 0
36 mol 254 unq 2 iso 0 dist 8.5372 11.4342 7.23916 9.84028 6.19835 7.85841 numMergedOcc 0
37 mol 254 unq 3 iso 0 dist 8.5372 11.2466 6.12653 9.84028 6.19835 9.20109 numMergedOcc 0
38 mol 260 unq 0 iso 0 dist 7.58405 8.79837 5.30187 13.0633 5.91135 6.48099 numMergedOcc 0
39 mol 287 unq 0 iso 0 dist 8.40198 12.0298 5.50067 14.6295 8.99193 4.68668 numMergedOcc 0
40 mol 287 unq 1 iso 0 dist 9.11967 11.6897 5.50067 16.0429 8.99193 4.68668 numMergedOcc 0
41 mol 288 unq 0 iso 0 dist 8.40198 12.0298 5.50067 14.6295 8.99193 4.68668 numMergedOcc 0
42 mol 288 unq 1 iso 0 dist 9.11967 11.6897 5.50067 16.0429 8.99193 4.68668 numMergedOcc 0
43 mol 289 unq 0 iso 0 dist 8.40198 12.0298 5.50067 14.6295 8.99193 4.68668 numMergedOcc 0
44 mol 289 unq 1 iso 0 dist 9.11967 11.6897 5.50067 16.0429 8.99193 4.68668 numMergedOcc 0
