0 mol 59 unq 0 iso 0 dist 5.81747 9.59244 10.6918 7.69638 5.87788 11.1914 4.90216 4.82623 11.6713 3.68327 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 5.81747 9.59244 10.6918 7.69638 5.87788 11.1914 9.84217 8.76577 3.88148 9.13939 numMergedOcc 0
2 mol 59 unq 2 iso 0 dist 6.81975 9.59244 7.5168 7.69638 5.46359 11.1914 4.90216 6.24283 11.6713 3.68327 numMergedOcc 0
3 mol 59 unq 3 iso 0 dist 6.81975 9.59244 7.5168 7.69638 5.46359 11.1914 9.84217 5.00893 3.88148 9.13939 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.59503 8.4545 4.73713 5.62309 11.9687 8.70803 7.29864 13.947 11.3522 3.79182 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.59503 8.4545 4.73713 5.62309 11.9687 8.70803 7.7399 14.5986 12.2908 8.93569 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 9.59503 8.4545 4.73713 7.11438 12.841 9.52327 7.29864 13.947 11.3522 9.74373 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 9.59503 8.4545 4.73713 7.11438 12.841 9.52327 7.7399 14.5986 12.2908 3.98877 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 9.59503 7.01176 4.36394 5.62309 11.9687 8.87994 7.29864 13.947 10.0591 3.79182 numMergedOcc 0
9 mol 92 unq 5 iso 0 dist 9.59503 7.01176 4.36394 5.62309 11.9687 8.87994 7.7399 14.5986 13.6054 8.93569 numMergedOcc 0
10 mol 92 unq 6 iso 0 dist 9.59503 7.01176 4.36394 7.11438 12.841 11.641 7.29864 13.947 10.0591 9.74373 numMergedOcc 0
11 mol 92 unq 7 iso 0 dist 9.59503 7.01176 4.36394 7.11438 12.841 11.641 7.7399 14.5986 13.6054 3.98877 numMergedOcc 0
12 mol 92 unq 8 iso 0 dist 9.61119 8.4545 9.29076 5.62309 11.8069 8.70803 7.29864 11.6652 11.3522 3.79182 numMergedOcc 0
13 mol 92 unq 9 iso 0 dist 9.61119 8.4545 9.29076 5.62309 11.8069 8.70803 7.7399 17.052 12.2908 8.93569 numMergedOcc 0
14 mol 92 unq 10 iso 0 dist 9.61119 8.4545 9.29076 7.11438 15.4853 9.52327 7.29864 11.6652 11.3522 9.74373 numMergedOcc 0
15 mol 92 unq 11 iso 0 dist 9.61119 8.4545 9.29076 7.11438 15.4853 9.52327 7.7399 17.052 12.2908 3.98877 numMergedOcc 0
16 mol 92 unq 12 iso 0 dist 9.61119 7.01176 4.39652 5.62309 11.8069 8.87994 7.29864 11.6652 10.0591 3.79182 numMergedOcc 0
17 mol 92 unq 13 iso 0 dist 9.61119 7.01176 4.39652 5.62309 11.8069 8.87994 7.7399 17.052 13.6054 8.93569 numMergedOcc 0
18 mol 92 unq 14 iso 0 dist 9.61119 7.01176 4.39652 7.11438 15.4853 11.641 7.29864 11.6652 10.0591 9.74373 numMergedOcc 0
19 mol 92 unq 15 iso 0 dist 9.61119 7.01176 4.39652 7.11438 15.4853 11.641 7.7399 17.052 13.6054 3.98877 numMergedOcc 0
20 mol 112 unq 0 iso 0 dist 8.06034 5.17585 5.48442 8.23777 10.347 5.76098 9.60648 3.37479 5.53441 10.2723 numMergedOcc 0
21 mol 120 unq 0 iso 0 dist 8.43293 7.04864 5.89379 8.73484 6.71699 8.2619 8.03124 3.71884 3.35803 8.87094 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 7.12336 9.50322 6.26797 6.72323 12.6435 12.538 8.52036 5.56456 10.3893 12.7291 numMergedOcc 0
23 mol 133 unq 1 iso 0 dist 7.12336 5.82404 9.73435 6.72323 12.6435 4.54648 8.52036 5.56456 11.323 12.7291 numMergedOcc 0
24 mol 154 unq 0 iso 0 dist 7.10223 6.23399 5.5065 5.60184 9.10645 7.51976 6.12278 11.9194 10.3287 4.03185 numMergedOcc 0
25 mol 154 unq 1 iso 0 dist 7.10223 6.23399 5.5065 8.86862 5.6364 5.02794 6.12278 11.9194 10.3287 11.2909 numMergedOcc 0
26 mol 154 unq 2 iso 0 dist 7.10223 6.23399 5.5065 7.08477 4.02111 7.23684 6.12278 11.9194 10.3287 9.94519 numMergedOcc 0
27 mol 169 unq 0 iso 0 dist 8.44483 9.46833 14.0747 7.91434 13.754 4.62636 7.50458 3.69097 13.9883 14.0793 numMergedOcc 0
28 mol 169 unq 1 iso 0 dist 8.44483 9.46833 14.0747 7.91434 13.754 4.62636 5.79554 7.14832 14.8937 13.629 numMergedOcc 0
29 mol 169 unq 2 iso 0 dist 8.44483 9.46833 14.0747 7.91434 13.754 4.62636 4.22003 8.01356 13.4235 11.1464 numMergedOcc 0
30 mol 169 unq 3 iso 0 dist 8.44483 9.46833 14.0747 7.79437 15.222 5.81985 7.50458 3.69097 13.9883 14.1141 numMergedOcc 0
31 mol 169 unq 4 iso 0 dist 8.44483 9.46833 14.0747 7.79437 15.222 5.81985 5.79554 7.14832 14.8937 13.1539 numMergedOcc 0
32 mol 169 unq 5 iso 0 dist 8.44483 9.46833 14.0747 7.79437 15.222 5.81985 4.22003 8.01356 13.4235 11.6489 numMergedOcc 0
33 mol 169 unq 6 iso 0 dist 9.79864 9.46833 11.1911 7.91434 9.38287 4.62636 7.50458 11.5623 13.9883 14.0793 numMergedOcc 0
34 mol 169 unq 7 iso 0 dist 9.79864 9.46833 11.1911 7.91434 9.38287 4.62636 5.79554 12.6041 14.8937 13.629 numMergedOcc 0
35 mol 169 unq 8 iso 0 dist 9.79864 9.46833 11.1911 7.91434 9.38287 4.62636 4.22003 10.4049 13.4235 11.1464 numMergedOcc 0
36 mol 169 unq 9 iso 0 dist 9.79864 9.46833 11.1911 7.79437 13.8794 5.81985 7.50458 11.5623 13.9883 14.1141 numMergedOcc 0
37 mol 169 unq 10 iso 0 dist 9.79864 9.46833 11.1911 7.79437 13.8794 5.81985 5.79554 12.6041 14.8937 13.1539 numMergedOcc 0
38 mol 169 unq 11 iso 0 dist 9.79864 9.46833 11.1911 7.79437 13.8794 5.81985 4.22003 10.4049 13.4235 11.6489 numMergedOcc 0
39 mol 169 unq 12 iso 0 dist 9.73241 9.46833 9.31064 7.91434 4.80754 4.62636 7.50458 16.721 13.9883 14.0793 numMergedOcc 0
40 mol 169 unq 13 iso 0 dist 9.73241 9.46833 9.31064 7.91434 4.80754 4.62636 5.79554 14.8989 14.8937 13.629 numMergedOcc 0
41 mol 169 unq 14 iso 0 dist 9.73241 9.46833 9.31064 7.91434 4.80754 4.62636 4.22003 11.6433 13.4235 11.1464 numMergedOcc 0
42 mol 169 unq 15 iso 0 dist 9.73241 9.46833 9.31064 7.79437 8.15907 5.81985 7.50458 16.721 13.9883 14.1141 numMergedOcc 0
43 mol 169 unq 16 iso 0 dist 9.73241 9.46833 9.31064 7.79437 8.15907 5.81985 5.79554 14.8989 14.8937 13.1539 numMergedOcc 0
44 mol 169 unq 17 iso 0 dist 9.73241 9.46833 9.31064 7.79437 8.15907 5.81985 4.22003 11.6433 13.4235 11.6489 numMergedOcc 0
45 mol 171 unq 0 iso 0 dist 8.59783 6.07091 9.22906 6.80086 13.1204 7.35753 7.06555 14.5273 10.0225 3.72812 numMergedOcc 0
46 mol 210 unq 0 iso 0 dist 9.718 8.62103 14.2438 9.26092 9.53964 10.4168 9.49242 12.6983 9.97638 3.71145 numMergedOcc 0
47 mol 210 unq 1 iso 0 dist 9.718 8.62103 14.2438 9.26092 9.53964 10.4168 9.25184 12.162 4.29623 11.0674 numMergedOcc 0
48 mol 210 unq 2 iso 0 dist 8.61629 8.62103 11.4281 9.26092 5.82101 10.4168 9.49242 9.16249 9.97638 3.71145 numMergedOcc 0
49 mol 210 unq 3 iso 0 dist 8.61629 8.62103 11.4281 9.26092 5.82101 10.4168 9.25184 9.9492 4.29623 11.0674 numMergedOcc 0
50 mol 244 unq 0 iso 0 dist 5.06669 7.65388 11.6777 5.79898 10.6799 5.17744 5.16859 3.62882 9.54706 10.1665 numMergedOcc 0
51 mol 244 unq 1 iso 0 dist 5.06669 7.65388 11.6777 5.79898 10.6799 5.17744 4.79207 7.8506 4.06591 5.68434 numMergedOcc 0
52 mol 244 unq 2 iso 0 dist 5.65248 7.65388 7.45211 5.79898 8.05133 5.17744 5.16859 5.2503 9.54706 10.1665 numMergedOcc 0
53 mol 244 unq 3 iso 0 dist 5.65248 7.65388 7.45211 5.79898 8.05133 5.17744 4.79207 3.66626 4.06591 5.68434 numMergedOcc 0
