0 mol 17 unq 0 iso 0 dist 9.52568 9.38298 9.4204 11.1352 16.6039 8.58468 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 9.15735 9.38298 17.5895 11.1352 19.9003 8.58468 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.26742 7.03345 15.4162 4.44274 11.7614 8.34763 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 9.26742 5.2296 12.1495 4.44274 11.7614 5.66008 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 9.90537 5.47819 10.946 4.78617 13.0028 5.99879 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.99189 9.49371 5.22567 6.4157 10.5228 7.63813 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.94097 5.05941 5.22567 7.10225 10.5228 7.63813 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 8.90417 9.05293 9.59932 4.39945 8.21723 6.00684 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 9.4827 6.71787 9.50212 4.5649 13.2789 9.20977 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 9.0788 6.71787 10.8474 4.5649 7.79845 9.20977 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 7.70662 5.13315 7.9212 5.57652 10.9842 6.3247 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 8.10832 4.85533 5.52017 4.34513 10.1306 5.53162 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 8.30526 8.32792 5.31074 4.8681 5.1498 5.77947 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 8.30526 7.64364 12.8208 8.46894 16.3113 9.92336 numMergedOcc 0
14 mol 220 unq 2 iso 0 dist 9.75871 8.32792 14.8436 4.8681 12.8999 5.77947 numMergedOcc 0
15 mol 220 unq 3 iso 0 dist 9.75871 7.64364 8.8331 8.46894 15.37 9.92336 numMergedOcc 0
16 mol 220 unq 4 iso 0 dist 8.62363 8.32792 14.1306 4.8681 13.2091 5.77947 numMergedOcc 0
17 mol 220 unq 5 iso 0 dist 8.62363 7.64364 3.24077 8.46894 8.68353 9.92336 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 6.6688 9.64956 11.0025 8.73613 10.6825 5.86702 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.62474 4.98594 9.89221 4.00824 6.55208 7.27283 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 9.62474 4.98594 9.89221 6.68601 7.17562 8.35447 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 8.01441 4.98594 6.87665 4.00824 11.9269 7.27283 numMergedOcc 0
22 mol 266 unq 3 iso 0 dist 8.01441 4.98594 6.87665 6.68601 13.3158 8.35447 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.2905 8.36667 5.0671 8.0951 11.7305 9.10723 numMergedOcc 0
24 mol 279 unq 1 iso 0 dist 8.2905 6.74021 6.42071 4.30447 11.1371 7.81641 numMergedOcc 0
25 mol 279 unq 2 iso 0 dist 9.47256 8.36667 7.96104 8.0951 15.1625 9.10723 numMergedOcc 0
26 mol 279 unq 3 iso 0 dist 9.47256 6.74021 5.75891 4.30447 10.2877 7.81641 numMergedOcc 0
