0 mol 46 unq 0 iso 0 dist 8.13664 11.8465 5.92771 8.59614 3.77542 4.38299 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 5.23167 7.90724 6.42645 3.89181 4.46067 7.49995 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 7.47607 5.4222 6.42645 5.72955 4.46067 7.49995 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.75749 9.94722 6.72584 8.85486 7.50925 11.4698 numMergedOcc 0
4 mol 83 unq 1 iso 0 dist 9.75749 9.94722 6.72584 5.2891 6.96722 10.6239 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 7.64841 7.57916 8.93999 5.37018 9.31385 4.03393 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 7.64841 7.57916 8.93999 5.79975 6.98791 8.26567 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 6.91039 14.6524 7.99127 4.62104 4.3855 10.7652 numMergedOcc 0
8 mol 143 unq 1 iso 0 dist 5.24882 6.47184 8.72521 6.03327 4.3855 10.1404 numMergedOcc 0
9 mol 169 unq 0 iso 0 dist 9.3206 8.64921 9.03941 9.93901 5.10589 9.52806 numMergedOcc 0
10 mol 169 unq 1 iso 0 dist 6.18165 5.36769 8.80004 6.5732 5.10589 9.55863 numMergedOcc 0
11 mol 169 unq 2 iso 0 dist 6.18165 5.36769 8.80004 4.14139 4.63336 4.68959 numMergedOcc 0
12 mol 169 unq 3 iso 0 dist 6.18165 5.36769 8.80004 7.73206 6.10715 5.99532 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 6.32254 6.30772 6.95058 4.03856 8.65645 5.37694 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 6.32254 6.30772 6.95058 5.25264 6.85902 4.99447 numMergedOcc 0
15 mol 176 unq 2 iso 0 dist 8.89556 7.83546 6.95058 6.94233 8.65645 5.37694 numMergedOcc 0
16 mol 176 unq 3 iso 0 dist 8.89556 7.83546 6.95058 3.97245 6.85902 4.99447 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 9.3032 13.0713 9.06347 12.2934 5.10542 4.86105 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 8.10451 15.7378 9.06347 11.2635 5.10542 4.86105 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 6.02628 7.94428 8.56451 5.30931 7.04263 5.45648 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 7.36685 12.1805 9.02396 7.98379 7.8598 5.11028 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 7.36685 12.1805 9.02396 4.58167 8.25286 15.2885 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 9.20906 6.70951 7.48115 10.0526 7.80711 5.11028 numMergedOcc 0
23 mol 266 unq 3 iso 0 dist 9.20906 6.70951 7.48115 16.8584 9.9965 15.2885 numMergedOcc 0
24 mol 266 unq 4 iso 0 dist 9.03099 12.1805 7.48115 7.98379 7.80711 5.11028 numMergedOcc 0
25 mol 266 unq 5 iso 0 dist 9.03099 12.1805 7.48115 4.58167 9.9965 15.2885 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 7.34927 13.0309 9.00122 9.69757 7.98956 16.3502 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 7.34927 13.0309 9.00122 10.2113 5.86185 14.0447 numMergedOcc 0
28 mol 277 unq 2 iso 0 dist 7.34927 13.0309 9.00122 8.92993 6.79748 9.0121 numMergedOcc 0
29 mol 277 unq 3 iso 0 dist 7.54315 15.9806 9.00122 7.55695 7.98956 16.3502 numMergedOcc 0
30 mol 277 unq 4 iso 0 dist 7.54315 15.9806 9.00122 6.26644 5.86185 14.0447 numMergedOcc 0
31 mol 277 unq 5 iso 0 dist 7.54315 15.9806 9.00122 10.4453 6.79748 9.0121 numMergedOcc 0
32 mol 277 unq 6 iso 0 dist 7.88615 4.4071 6.47907 10.6003 6.53598 9.0121 numMergedOcc 0
