0 mol 54 unq 0 iso 0 dist 6.59498 7.54869 4.12189 5.50049 10.4776 9.5589 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 6.59498 6.29729 5.62305 5.50049 10.4776 6.83299 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.46204 7.40411 5.56908 11.5553 11.7867 7.71095 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 6.46204 7.40411 5.56908 6.31307 10.8982 8.84665 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 6.46204 7.40411 5.56908 5.76625 10.4591 8.25513 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.93754 8.83265 7.80518 6.69737 7.23812 8.70481 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.43163 8.83265 11.1406 6.69737 11.7558 8.70481 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.23603 8.79958 9.74526 8.55171 15.1637 9.33898 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 8.23603 8.79958 9.74526 8.36426 10.8252 9.64443 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 6.76306 9.90769 13.5076 11.0096 17.147 7.88289 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 6.76306 9.90769 13.5076 10.3117 15.7709 9.01083 numMergedOcc 0
11 mol 95 unq 2 iso 0 dist 6.76306 9.02255 12.0894 5.2048 9.64673 7.27724 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 7.08275 6.929 8.98235 6.28185 13.1738 8.58044 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 7.3607 5.8729 4.94374 9.80725 11.9929 8.69985 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 5.99206 6.70271 5.34829 10.8963 9.47554 7.11802 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 5.99206 6.2109 9.67676 11.6923 15.8406 6.29155 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 5.99206 6.2109 9.67676 12.4997 13.9771 6.80239 numMergedOcc 0
17 mol 133 unq 3 iso 0 dist 5.99206 6.2109 9.67676 10.8963 9.47554 8.00618 numMergedOcc 0
18 mol 133 unq 4 iso 0 dist 7.4615 6.70271 9.47995 10.8963 11.7499 7.11802 numMergedOcc 0
19 mol 133 unq 5 iso 0 dist 7.4615 6.2109 10.9364 11.6923 17.1647 6.29155 numMergedOcc 0
20 mol 133 unq 6 iso 0 dist 7.4615 6.2109 10.9364 12.4997 14.4401 6.80239 numMergedOcc 0
21 mol 133 unq 7 iso 0 dist 7.4615 6.2109 10.9364 10.8963 11.7499 8.00618 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 8.70051 6.94119 10.7797 12.4052 18.373 9.0018 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 8.70051 6.94119 10.7797 6.11854 13.5883 7.652 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 5.60183 6.40983 5.04299 8.48013 9.80543 6.03031 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 5.60183 6.40983 5.04299 9.6739 7.51951 7.26832 numMergedOcc 0
26 mol 205 unq 2 iso 0 dist 5.60183 6.40983 5.04299 11.3983 12.4766 7.80463 numMergedOcc 0
27 mol 205 unq 3 iso 0 dist 9.42888 6.40983 6.67585 8.48013 12.5552 6.03031 numMergedOcc 0
28 mol 205 unq 4 iso 0 dist 9.42888 6.40983 6.67585 9.6739 10.3464 7.26832 numMergedOcc 0
29 mol 205 unq 5 iso 0 dist 9.42888 6.40983 6.67585 11.3983 12.9085 7.80463 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 7.99439 6.7946 5.95421 6.32915 10.0508 5.81334 numMergedOcc 0
31 mol 264 unq 0 iso 0 dist 9.3754 7.51284 4.41644 11.5015 10.1878 6.24356 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 9.73489 8.61945 15.5667 9.21781 18.8868 9.7748 numMergedOcc 0
