0 mol 24 unq 0 iso 0 dist 9.58012 7.96195 5.11135 8.56274 4.21283 3.67206 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.31982 7.15901 4.55347 9.82307 6.59887 5.14161 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.58543 7.69861 5.24993 8.59337 12.2331 9.21869 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.58543 7.69861 5.24993 7.66942 4.53496 6.06973 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 5.51624 7.8435 4.97727 6.46217 10.1484 13.6138 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 5.51624 5.99269 5.77343 6.46217 10.1484 12.3588 numMergedOcc 0
6 mol 93 unq 2 iso 0 dist 5.51624 5.71763 11.0802 6.46217 10.1484 4.98621 numMergedOcc 0
7 mol 93 unq 3 iso 0 dist 7.8674 6.18348 7.92049 6.25522 5.99863 5.31693 numMergedOcc 0
8 mol 93 unq 4 iso 0 dist 7.8674 6.18348 7.92049 7.87145 6.15015 3.09636 numMergedOcc 0
9 mol 93 unq 5 iso 0 dist 7.8674 6.18348 7.92049 9.30914 10.9803 3.7348 numMergedOcc 0
10 mol 93 unq 6 iso 0 dist 7.8674 7.8435 13.8087 6.46217 10.2139 13.6138 numMergedOcc 0
11 mol 93 unq 7 iso 0 dist 7.8674 5.99269 9.96831 6.46217 10.2139 12.3588 numMergedOcc 0
12 mol 93 unq 8 iso 0 dist 7.8674 5.71763 5.33894 6.46217 10.2139 4.98621 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 5.73236 7.16698 6.55089 8.56866 5.29609 3.37746 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 5.73236 7.16698 6.55089 5.66207 7.87644 8.92479 numMergedOcc 0
15 mol 143 unq 2 iso 0 dist 5.73236 8.68663 6.16103 8.56866 5.29609 8.45583 numMergedOcc 0
16 mol 143 unq 3 iso 0 dist 5.73236 8.68663 6.16103 5.66207 7.87644 5.94217 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 9.23528 9.43989 17.3765 7.19893 9.20965 15.2813 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 9.23528 9.43989 17.3765 6.37938 4.60996 14.3635 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 8.60521 7.1069 10.6183 9.48674 13.909 5.12696 numMergedOcc 0
20 mol 152 unq 1 iso 0 dist 8.60521 6.09987 5.55763 5.42715 4.78989 6.15601 numMergedOcc 0
21 mol 152 unq 2 iso 0 dist 8.60521 6.09987 5.55763 9.70575 9.43672 12.1717 numMergedOcc 0
22 mol 152 unq 3 iso 0 dist 6.39031 7.1069 4.71678 9.48674 6.69469 5.12696 numMergedOcc 0
23 mol 152 unq 4 iso 0 dist 6.39031 6.92726 5.55763 7.34557 4.78989 6.15601 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 8.12349 8.31881 6.38897 9.12783 6.3786 3.11607 numMergedOcc 0
25 mol 218 unq 0 iso 0 dist 9.06334 8.04838 7.92114 6.62738 3.98561 9.10705 numMergedOcc 0
26 mol 218 unq 1 iso 0 dist 9.06334 8.04838 7.92114 7.13254 5.11748 8.25033 numMergedOcc 0
27 mol 250 unq 0 iso 0 dist 9.60364 7.22664 8.9822 7.5999 10.18 3.18526 numMergedOcc 0
28 mol 250 unq 1 iso 0 dist 9.60364 7.22664 8.9822 9.50976 8.13777 4.97183 numMergedOcc 0
29 mol 250 unq 2 iso 0 dist 9.60364 7.15762 11.5018 7.5999 10.18 9.28743 numMergedOcc 0
30 mol 250 unq 3 iso 0 dist 9.60364 7.15762 11.5018 9.50976 8.13777 6.00379 numMergedOcc 0
31 mol 264 unq 0 iso 0 dist 5.74568 7.14086 7.36132 8.78525 7.06901 10.1726 numMergedOcc 0
