0 mol 24 unq 0 iso 0 dist 9.54519 6.36381 5.50396 8.6586 6.7846 3.67206 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.89136 9.37435 7.12408 8.97566 3.98709 4.79817 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 6.89136 9.37435 7.12408 8.81085 10.394 5.2495 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 6.88695 9.63803 8.25132 7.89667 8.39015 8.86888 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 5.5814 8.98564 5.53425 5.80534 6.61952 9.85891 numMergedOcc 0
5 mol 30 unq 1 iso 0 dist 5.5814 7.51725 4.20285 5.80534 6.61952 4.94024 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.4551 6.63973 6.77898 6.46582 3.69293 3.35924 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 5.9747 8.3505 3.9764 9.68556 13.6536 17.213 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 5.9747 7.34638 7.03983 9.68556 13.6536 11.0062 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 8.01677 9.45412 10.0888 5.38983 4.48309 11.7784 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 6.38163 6.53559 6.28232 7.04904 10.3933 12.7725 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 6.38163 6.53559 6.28232 5.06053 9.27274 10.2785 numMergedOcc 0
12 mol 129 unq 2 iso 0 dist 6.38163 7.90844 12.3705 7.04904 10.3933 9.39617 numMergedOcc 0
13 mol 129 unq 3 iso 0 dist 6.38163 7.90844 12.3705 5.06053 9.27274 6.48525 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 9.46833 6.00783 6.52671 7.50458 13.9883 9.60496 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 9.46833 6.00783 6.52671 5.79554 14.8937 10.5251 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 9.46833 6.00783 6.52671 4.22003 13.4235 8.67112 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 6.07091 6.51523 7.5383 7.06555 10.0225 7.20382 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.96988 9.18289 13.0315 6.99587 9.14919 4.97041 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 8.96988 9.18289 13.0315 4.37577 9.11577 6.50779 numMergedOcc 0
20 mol 186 unq 2 iso 0 dist 8.96988 6.52441 10.6555 6.99587 9.14919 4.75583 numMergedOcc 0
21 mol 186 unq 3 iso 0 dist 8.96988 6.52441 10.6555 4.37577 9.11577 3.11607 numMergedOcc 0
22 mol 186 unq 4 iso 0 dist 8.96988 6.26168 5.75483 6.99587 9.14919 5.53349 numMergedOcc 0
23 mol 186 unq 5 iso 0 dist 8.96988 6.26168 5.75483 4.37577 9.11577 4.65666 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 6.752 6.41148 8.67921 8.93485 5.42503 6.49396 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 8.10287 5.06713 8.90569 5.66636 4.69695 6.49396 numMergedOcc 0
26 mol 205 unq 2 iso 0 dist 8.10287 8.69512 6.37317 5.66636 4.69695 8.93955 numMergedOcc 0
27 mol 205 unq 3 iso 0 dist 5.4913 5.06713 8.67921 5.66636 5.42503 6.49396 numMergedOcc 0
28 mol 205 unq 4 iso 0 dist 5.4913 8.69512 12.8695 5.66636 5.42503 8.93955 numMergedOcc 0
29 mol 222 unq 0 iso 0 dist 7.85877 8.86886 8.34852 4.90656 8.89157 10.1968 numMergedOcc 0
30 mol 244 unq 0 iso 0 dist 7.65388 9.11416 6.89444 5.16859 9.54706 12.3227 numMergedOcc 0
31 mol 244 unq 1 iso 0 dist 7.65388 9.11416 6.89444 4.79207 4.06591 7.21693 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 6.55855 4.97796 8.87855 9.82713 4.60007 10.6981 numMergedOcc 0
33 mol 274 unq 1 iso 0 dist 9.52894 4.97796 13.0867 9.82713 10.9558 10.6981 numMergedOcc 0
