0 mol 32 unq 0 iso 0 dist 8.33273 11.3911 8.74576 10.0999 5.57199 7.48825 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 9.16481 7.70136 9.65897 4.31912 6.49199 7.18766 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.61802 6.68767 5.91068 6.57908 4.22398 8.55901 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.87762 15.2801 7.79336 13.1342 10.3961 8.55901 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 8.87762 15.2801 7.79336 16.5812 9.85481 9.03412 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 8.21762 15.2801 7.08559 13.1342 7.52709 8.55901 numMergedOcc 0
6 mol 34 unq 4 iso 0 dist 8.21762 15.2801 7.08559 16.5812 10.3431 9.03412 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 7.63443 6.1599 7.60018 13.773 10.7257 8.80108 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 5.40287 6.1599 7.03126 13.773 11.0945 8.80108 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 5.14123 9.82767 8.35444 10.2592 6.61741 6.90952 numMergedOcc 0
10 mol 88 unq 0 iso 0 dist 5.90605 5.25762 5.28732 10.882 6.67934 7.71582 numMergedOcc 0
11 mol 88 unq 1 iso 0 dist 5.90605 5.25762 5.28732 7.44647 4.39545 6.65776 numMergedOcc 0
12 mol 135 unq 0 iso 0 dist 8.55869 8.30838 9.09753 12.245 7.17391 9.1005 numMergedOcc 0
13 mol 135 unq 1 iso 0 dist 6.65965 8.30838 7.6337 12.245 6.06659 9.1005 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 6.31404 5.93604 4.26972 5.76702 6.37052 8.55681 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 8.38459 4.91881 5.461 13.4998 7.09198 8.74171 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 6.20862 6.299 8.91356 4.90724 3.92979 8.75834 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 6.20862 6.299 8.91356 13.3874 13.317 7.51827 numMergedOcc 0
18 mol 225 unq 2 iso 0 dist 6.20862 9.63082 9.59574 4.90724 3.92979 9.36396 numMergedOcc 0
19 mol 225 unq 3 iso 0 dist 7.27888 13.7014 8.91356 11.0795 3.92979 8.75834 numMergedOcc 0
20 mol 225 unq 4 iso 0 dist 7.27888 13.7014 8.91356 15.2185 13.317 7.51827 numMergedOcc 0
21 mol 225 unq 5 iso 0 dist 7.27888 13.9767 9.59574 11.0795 3.92979 9.36396 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 7.86214 6.99665 6.01775 9.38859 9.59241 9.2911 numMergedOcc 0
23 mol 233 unq 1 iso 0 dist 5.29501 4.43794 6.01775 12.0307 9.59241 9.2911 numMergedOcc 0
24 mol 233 unq 2 iso 0 dist 8.81206 11.2489 6.01775 16.3699 9.59241 9.2911 numMergedOcc 0
25 mol 234 unq 0 iso 0 dist 4.37501 5.04225 8.27411 5.99388 6.00588 8.49841 numMergedOcc 0
26 mol 234 unq 1 iso 0 dist 4.37501 5.04225 8.27411 12.7447 13.9373 9.6101 numMergedOcc 0
27 mol 243 unq 0 iso 0 dist 5.91328 5.32118 9.33476 9.8043 10.106 9.1101 numMergedOcc 0
28 mol 270 unq 0 iso 0 dist 9.34963 9.0548 9.04189 15.0631 10.7047 9.16073 numMergedOcc 0
29 mol 270 unq 1 iso 0 dist 9.34963 9.0548 9.04189 9.4555 4.4142 6.79822 numMergedOcc 0
30 mol 270 unq 2 iso 0 dist 9.6012 6.83592 9.51462 13.1037 7.66392 8.39167 numMergedOcc 0
31 mol 270 unq 3 iso 0 dist 9.6012 6.83592 9.51462 9.94203 3.98629 9.17227 numMergedOcc 0
