0 mol 29 unq 0 iso 0 dist 9.99467 5.97548 5.36278 4.31895 7.28761 4.10356 numMergedOcc 0
1 mol 29 unq 1 iso 0 dist 9.99467 9.88128 7.50258 4.31895 7.28761 10.3687 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 6.51139 10.8697 6.75602 9.88933 9.88728 7.22319 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.76585 6.95983 8.84944 6.90686 7.32236 10.9311 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.76585 11.3999 7.21995 6.90686 7.32236 6.43999 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.27044 12.456 7.58027 6.73631 9.8821 11.6826 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.98208 12.456 4.34694 6.73631 8.80003 11.6826 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.73093 12.3943 7.48556 12.2641 8.61566 10.5152 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 8.73093 12.3943 7.48556 5.3163 5.02942 9.39279 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 8.02104 9.57143 7.48556 11.4792 8.61566 10.5152 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 8.02104 9.57143 7.48556 5.18759 5.02942 9.39279 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.79677 11.5575 6.54778 3.46142 9.68809 13.6126 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 8.79677 4.66388 8.57909 3.46142 9.68809 7.56584 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.66811 7.14779 9.65031 13.2207 9.17101 10.9552 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 9.66811 9.85198 8.51844 13.2207 9.17101 6.05258 numMergedOcc 0
15 mol 158 unq 0 iso 0 dist 8.80952 11.2678 9.96635 8.84312 8.79758 10.1247 numMergedOcc 0
16 mol 159 unq 0 iso 0 dist 8.20121 10.242 6.86212 7.38933 7.85744 4.72814 numMergedOcc 0
17 mol 159 unq 1 iso 0 dist 7.52779 10.242 9.9368 7.2995 7.67418 13.464 numMergedOcc 0
18 mol 165 unq 0 iso 0 dist 9.63241 7.28318 5.99596 12.0001 8.01191 9.93041 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 6.28957 5.44954 7.20545 5.88294 9.26916 10.5008 numMergedOcc 0
20 mol 167 unq 1 iso 0 dist 7.34285 9.15105 7.20545 3.50968 9.26916 10.5008 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 10.9895 8.11956 11.4764 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 7.81904 6.6097 7.91838 5.21325 8.62286 9.81023 numMergedOcc 0
23 mol 187 unq 0 iso 0 dist 7.87608 8.91643 8.0501 5.9319 8.38922 4.8196 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 9.78743 13.2525 6.2016 15.5077 5.90008 7.71442 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 4.53228 10.9464 8.26312 13.1778 9.90442 7.80147 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 4.53228 6.54316 7.58554 13.1778 9.90442 10.7751 numMergedOcc 0
27 mol 239 unq 2 iso 0 dist 8.54078 10.4394 8.26312 15.589 9.90442 7.80147 numMergedOcc 0
28 mol 239 unq 3 iso 0 dist 8.54078 6.2497 7.58554 15.589 9.90442 10.7751 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 7.3055 6.1113 6.57444 16.1506 9.96942 16.3701 numMergedOcc 0
30 mol 266 unq 1 iso 0 dist 7.3055 14.487 9.39714 16.1506 9.96942 8.85331 numMergedOcc 0
31 mol 273 unq 0 iso 0 dist 6.91029 5.64983 6.02879 5.59076 9.85536 10.1193 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 9.16172 6.04816 7.83793 15.095 9.65535 16.4846 numMergedOcc 0
33 mol 279 unq 1 iso 0 dist 9.16172 6.04816 7.83793 12.0174 8.82519 12.7862 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.3799 9.82863 13.3487 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.3799 9.82863 13.3487 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.3799 9.82863 13.3487 numMergedOcc 0
