0 mol 9 unq 0 iso 0 dist 7.25179 7.95202 4.61049 6.62605 6.85412 10.3656 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.25179 7.95202 4.61049 4.75933 6.33889 6.9513 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 7.25179 6.75249 6.64015 6.62605 6.85412 11.0149 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 7.25179 6.75249 6.64015 4.75933 6.33889 9.16116 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 8.72522 6.21942 4.61049 11.0121 6.85412 10.3656 numMergedOcc 0
5 mol 9 unq 5 iso 0 dist 8.72522 6.21942 4.61049 6.35665 6.33889 6.9513 numMergedOcc 0
6 mol 9 unq 6 iso 0 dist 8.72522 6.38082 6.64015 11.0121 6.85412 11.0149 numMergedOcc 0
7 mol 9 unq 7 iso 0 dist 8.72522 6.38082 6.64015 6.35665 6.33889 9.16116 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 7.34549 9.08976 11.887 7.23551 6.73162 15.0652 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 9.89618 6.11881 13.469 12.4268 8.39016 13.2042 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.11612 9.36283 6.34759 5.39389 7.76729 7.99631 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 8.75736 6.77398 5.45435 9.88404 8.94837 12.4945 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 8.75736 5.68207 10.302 9.88404 8.94837 13.0721 numMergedOcc 0
13 mol 134 unq 2 iso 0 dist 6.76166 6.33375 5.9915 6.15672 8.94837 6.4218 numMergedOcc 0
14 mol 134 unq 3 iso 0 dist 6.76166 8.06229 5.45435 6.15672 8.94837 12.4945 numMergedOcc 0
15 mol 134 unq 4 iso 0 dist 6.32178 6.77398 8.47569 9.88404 7.77454 12.4945 numMergedOcc 0
16 mol 134 unq 5 iso 0 dist 6.32178 5.68207 5.99395 9.88404 7.77454 13.0721 numMergedOcc 0
17 mol 134 unq 6 iso 0 dist 7.2977 6.33375 10.7186 6.15672 7.77454 6.4218 numMergedOcc 0
18 mol 134 unq 7 iso 0 dist 7.2977 8.06229 8.47569 6.15672 7.77454 12.4945 numMergedOcc 0
19 mol 140 unq 0 iso 0 dist 6.40792 7.59889 4.90549 9.78198 8.19104 12.684 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 9.0847 9.65224 12.8308 12.6562 9.13561 20.1369 numMergedOcc 0
21 mol 178 unq 0 iso 0 dist 7.14849 8.71031 5.25267 8.42124 8.96511 12.6141 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 9.50454 7.82604 8.93318 10.9336 6.93764 14.5121 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 9.50454 8.22583 9.60512 10.9336 6.93764 10.7841 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 7.15963 7.82604 8.25067 9.09192 6.94688 8.20656 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 7.15963 7.82604 8.25067 12.1848 6.71012 9.40622 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 7.15963 8.22583 14.8479 9.09192 6.94688 15.3556 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 7.15963 8.22583 14.8479 12.1848 6.71012 18.842 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 4.91961 6.553 5.56749 12.2893 9.5707 8.49841 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 4.91961 6.553 5.56749 11.1927 7.85175 10.0446 numMergedOcc 0
30 mol 234 unq 2 iso 0 dist 4.91961 6.5097 7.50943 12.2893 9.5707 13.3583 numMergedOcc 0
31 mol 234 unq 3 iso 0 dist 4.91961 6.5097 7.50943 11.1927 7.85175 14.2322 numMergedOcc 0
32 mol 234 unq 4 iso 0 dist 7.14333 6.553 8.0608 10.3017 9.39181 11.8534 numMergedOcc 0
33 mol 234 unq 5 iso 0 dist 7.14333 6.5097 9.38219 10.3017 9.39181 15.2449 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 8.39522 6.59305 6.20606 10.4124 6.91569 11.9092 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 8.69345 5.68415 5.20486 13.2072 7.50578 12.0729 numMergedOcc 0
