0 mol 6 unq 0 iso 0 dist 8.39598 6.8041 6.45138 10.9641 7.6781 12.1046 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.72467 8.58962 5.48936 7.65753 9.56614 7.37118 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.78264 6.8073 4.70231 10.5685 7.02387 5.7836 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 6.78264 6.8073 4.70231 4.92775 8.92898 5.89173 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 6.78264 5.60663 6.75645 10.5685 7.02387 10.0533 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 6.78264 5.60663 6.75645 4.92775 8.92898 9.6736 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 8.80334 6.42242 12.8187 5.39197 8.44353 7.20729 numMergedOcc 0
7 mol 48 unq 5 iso 0 dist 8.80334 6.42242 12.8187 9.53255 6.11249 13.73 numMergedOcc 0
8 mol 48 unq 6 iso 0 dist 8.80334 6.42242 12.8187 7.75132 7.86326 11.6534 numMergedOcc 0
9 mol 48 unq 7 iso 0 dist 8.80334 6.42242 12.8187 12.4977 4.74786 15.8154 numMergedOcc 0
10 mol 48 unq 8 iso 0 dist 8.45484 6.8073 12.7671 11.8742 4.53565 15.5445 numMergedOcc 0
11 mol 48 unq 9 iso 0 dist 8.45484 6.8073 12.7671 5.44298 8.53722 7.32996 numMergedOcc 0
12 mol 48 unq 10 iso 0 dist 8.45484 6.8073 12.7671 9.10301 6.15814 13.8202 numMergedOcc 0
13 mol 48 unq 11 iso 0 dist 8.45484 6.8073 12.7671 7.24268 7.70284 11.605 numMergedOcc 0
14 mol 48 unq 12 iso 0 dist 8.45484 5.60663 4.40229 11.8742 4.53565 8.56365 numMergedOcc 0
15 mol 48 unq 13 iso 0 dist 8.45484 5.60663 4.40229 5.44298 8.53722 7.47783 numMergedOcc 0
16 mol 48 unq 14 iso 0 dist 8.45484 5.60663 4.40229 9.10301 6.15814 8.74151 numMergedOcc 0
17 mol 48 unq 15 iso 0 dist 8.45484 5.60663 4.40229 7.24268 7.70284 8.69662 numMergedOcc 0
18 mol 101 unq 0 iso 0 dist 7.43143 7.73086 7.83985 4.4529 8.35515 9.44645 numMergedOcc 0
19 mol 102 unq 0 iso 0 dist 6.793 9.2062 6.34242 6.04036 7.68537 6.07633 numMergedOcc 0
20 mol 116 unq 0 iso 0 dist 9.66069 7.92221 4.94926 8.53743 6.28029 8.58308 numMergedOcc 0
21 mol 127 unq 0 iso 0 dist 5.45159 9.00087 6.91576 7.7486 9.70065 15.1526 numMergedOcc 0
22 mol 127 unq 1 iso 0 dist 4.9835 8.66991 6.91576 6.99745 9.70065 15.1526 numMergedOcc 0
23 mol 158 unq 0 iso 0 dist 8.37022 8.07946 6.05893 5.34159 8.40257 7.20362 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 8.5372 7.28781 6.6011 11.4342 7.23916 11.5842 numMergedOcc 0
25 mol 254 unq 1 iso 0 dist 8.5372 7.28781 6.6011 11.2466 6.12653 9.50951 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 5.45375 9.54381 6.99137 6.09382 9.50158 9.32971 numMergedOcc 0
