0 mol 32 unq 0 iso 0 dist 8.70934 5.91961 7.18766 11.5166 5.19476 7.11053 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 6.35945 4.72799 7.48825 9.89494 8.73368 7.11053 numMergedOcc 0
2 mol 32 unq 2 iso 0 dist 4.31912 7.70136 7.18766 9.16481 6.49199 9.65897 numMergedOcc 0
3 mol 32 unq 3 iso 0 dist 4.31912 6.44894 7.48825 9.33105 5.57199 8.74576 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 6.57908 6.68767 8.55901 7.61802 4.22398 5.91068 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.97598 5.45426 7.71582 10.267 6.67934 5.28732 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 7.44647 5.25762 6.65776 5.90605 4.39545 5.28732 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 8.50045 14.1282 8.39249 12.5083 4.81369 5.51885 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.82363 10.6383 8.55681 11.438 6.37052 4.26972 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 5.76702 5.93604 8.55681 6.31404 6.37052 4.26972 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 7.29635 12.5331 8.75834 12.3975 11.3004 5.93063 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 4.90724 6.299 8.75834 6.20862 3.92979 8.91356 numMergedOcc 0
12 mol 225 unq 2 iso 0 dist 4.90724 6.299 8.75834 11.8187 9.35263 9.57455 numMergedOcc 0
13 mol 225 unq 3 iso 0 dist 4.90724 9.63082 9.36396 6.20862 3.92979 9.59574 numMergedOcc 0
14 mol 225 unq 4 iso 0 dist 7.01671 6.98496 8.75834 10.0037 3.92979 8.91356 numMergedOcc 0
15 mol 225 unq 5 iso 0 dist 7.01671 6.98496 8.75834 10.5419 9.35263 9.57455 numMergedOcc 0
16 mol 225 unq 6 iso 0 dist 7.01671 13.7921 9.36396 10.0037 3.92979 9.59574 numMergedOcc 0
17 mol 225 unq 7 iso 0 dist 8.23463 6.4725 9.36396 10.2112 11.0634 5.93063 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.187 5.38513 6.152 10.3433 5.99236 9.8009 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 9.187 13.6352 7.95168 15.6121 12.0749 7.79951 numMergedOcc 0
20 mol 233 unq 0 iso 0 dist 9.38859 6.99665 9.2911 13.5679 9.35904 8.24424 numMergedOcc 0
21 mol 233 unq 1 iso 0 dist 9.38859 6.99665 9.2911 10.934 5.88701 7.0942 numMergedOcc 0
22 mol 233 unq 2 iso 0 dist 9.38859 6.99665 9.2911 7.86214 9.59241 6.01775 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 5.99388 5.04225 8.49841 4.37501 6.00588 8.27411 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 5.99388 5.04225 8.49841 11.866 14.8966 6.96257 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 9.8043 5.32118 9.1101 5.91328 10.106 9.33476 numMergedOcc 0
26 mol 270 unq 0 iso 0 dist 9.4555 9.0548 6.79822 9.34963 4.4142 9.04189 numMergedOcc 0
27 mol 270 unq 1 iso 0 dist 9.4555 11.3548 9.17227 10.3328 3.98629 9.51462 numMergedOcc 0
28 mol 270 unq 2 iso 0 dist 9.4555 11.3548 9.17227 15.4894 8.41656 8.12971 numMergedOcc 0
29 mol 270 unq 3 iso 0 dist 9.94203 9.28469 6.79822 12.2451 4.4142 9.04189 numMergedOcc 0
30 mol 270 unq 4 iso 0 dist 9.94203 6.83592 9.17227 9.6012 3.98629 9.51462 numMergedOcc 0
31 mol 270 unq 5 iso 0 dist 9.94203 6.83592 9.17227 12.2684 8.41656 8.12971 numMergedOcc 0
