0 mol 8 unq 0 iso 0 dist 8.80278 8.23769 5.86575 4.35292 9.36839 11.0865 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.0009 8.81795 8.73619 4.39847 7.8986 4.97843 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 8.91298 8.81795 8.70732 4.39847 7.24183 4.97843 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 7.33546 7.01186 8.57358 7.83359 9.22636 12.8699 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 8.70106 8.68825 13.2825 11.4822 7.81042 15.122 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 7.82151 6.41059 5.80806 9.05726 9.95726 11.9027 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 7.63425 8.24275 7.32307 12.9585 9.86842 16.6501 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 7.14447 8.2746 8.17517 12.8539 8.15549 13.3772 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 6.72591 9.69869 5.27089 7.50382 9.71692 14.6888 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 6.72591 4.7785 6.16168 7.50382 9.71692 11.144 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 6.80192 9.67177 5.24014 7.48524 9.73708 14.6594 numMergedOcc 0
11 mol 150 unq 1 iso 0 dist 6.80192 4.79493 6.14967 7.48524 9.73708 11.1402 numMergedOcc 0
12 mol 157 unq 0 iso 0 dist 6.66184 9.63472 12.5837 6.754 9.668 16.2823 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 9.0757 5.87728 12.848 16.3549 9.45847 17.4511 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 9.0757 5.87728 12.848 6.55123 7.895 12.2049 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 9.0757 6.71538 6.36605 16.3549 9.45847 10.3501 numMergedOcc 0
16 mol 184 unq 3 iso 0 dist 9.0757 6.71538 6.36605 6.55123 7.895 10.1031 numMergedOcc 0
17 mol 184 unq 4 iso 0 dist 9.0757 8.58856 8.2618 16.3549 9.45847 11.7115 numMergedOcc 0
18 mol 184 unq 5 iso 0 dist 9.0757 8.58856 8.2618 6.55123 7.895 11.4784 numMergedOcc 0
19 mol 184 unq 6 iso 0 dist 7.51045 6.76009 8.2618 9.14602 9.45847 11.7115 numMergedOcc 0
20 mol 184 unq 7 iso 0 dist 7.51045 6.76009 8.2618 13.1965 7.895 11.4784 numMergedOcc 0
21 mol 189 unq 0 iso 0 dist 8.81184 7.17249 10.6575 12.7403 8.23197 15.6552 numMergedOcc 0
22 mol 189 unq 1 iso 0 dist 9.71306 7.17249 13.8163 6.58275 5.11059 12.7674 numMergedOcc 0
23 mol 192 unq 0 iso 0 dist 9.67207 8.15486 14.6227 8.0557 7.30965 15.8981 numMergedOcc 0
24 mol 226 unq 0 iso 0 dist 7.6174 5.61473 7.32691 8.00807 7.20862 6.44662 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 7.19924 9.03093 10.9858 15.6809 9.09835 14.9822 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 7.19924 9.03093 10.9858 12.3037 7.21466 11.9213 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 9.94532 6.57783 8.59973 5.75427 8.13696 7.469 numMergedOcc 0
28 mol 260 unq 1 iso 0 dist 9.94532 6.18853 11.1345 5.75427 8.13696 10.6168 numMergedOcc 0
29 mol 260 unq 2 iso 0 dist 9.94532 9.39891 5.0414 5.75427 8.13696 5.9721 numMergedOcc 0
30 mol 283 unq 0 iso 0 dist 8.821 6.87568 10.7319 5.9309 7.53773 12.0328 numMergedOcc 0
31 mol 283 unq 1 iso 0 dist 9.82337 6.87568 7.05375 14.0912 8.3815 14.4097 numMergedOcc 0
32 mol 283 unq 2 iso 0 dist 9.82337 6.87568 7.05375 10.1502 7.13925 10.5778 numMergedOcc 0
33 mol 283 unq 3 iso 0 dist 6.3448 6.50648 7.05375 11.5049 8.3815 14.4097 numMergedOcc 0
34 mol 283 unq 4 iso 0 dist 6.3448 6.50648 7.05375 5.47552 7.13925 10.5778 numMergedOcc 0
