0 mol 1 unq 0 iso 0 dist 7.21349 7.90928 9.45781 6.35409 12.7552 8.56884 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.6112 9.97117 9.57165 5.3315 10.8071 6.73162 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.6112 8.62693 6.66387 10.2609 14.5062 8.82012 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 8.6112 8.62693 6.66387 4.09495 6.88695 9.16962 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 4.67917 8.17564 8.85727 10.6918 11.482 6.23899 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 5.81747 8.17564 4.07863 10.6918 9.59244 6.23899 numMergedOcc 0
6 mol 59 unq 2 iso 0 dist 6.88924 7.19213 8.85727 7.5168 11.482 6.23899 numMergedOcc 0
7 mol 59 unq 3 iso 0 dist 6.81975 7.19213 4.07863 7.5168 9.59244 6.23899 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 8.92399 9.4909 9.26242 8.66126 13.9848 8.30646 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.00003 9.75205 10.8145 15.6961 15.6893 9.10189 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 8.36326 6.64631 4.41983 3.96825 8.69069 8.67367 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.53731 7.50886 8.32999 9.09179 13.0299 6.73814 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 6.91762 8.02593 4.40049 5.01007 4.44292 7.39644 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 6.91762 8.02593 4.40049 9.80448 10.6076 7.36102 numMergedOcc 0
14 mol 155 unq 2 iso 0 dist 6.91762 7.62575 5.92486 14.7279 15.767 9.86313 numMergedOcc 0
15 mol 155 unq 3 iso 0 dist 6.91762 7.62575 5.92486 10.4606 12.6683 7.51198 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 5.75545 8.45395 6.22085 9.47799 10.6635 6.94688 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 5.75545 5.41368 4.48609 9.47799 10.6635 6.71012 numMergedOcc 0
18 mol 181 unq 2 iso 0 dist 8.86645 9.15368 6.22085 9.09989 10.6635 6.94688 numMergedOcc 0
19 mol 181 unq 3 iso 0 dist 8.86645 7.96182 4.48609 9.09989 10.6635 6.71012 numMergedOcc 0
20 mol 183 unq 0 iso 0 dist 8.15747 7.42108 9.54124 4.81807 12.5173 9.93083 numMergedOcc 0
21 mol 183 unq 1 iso 0 dist 8.15747 7.42108 9.54124 7.79648 12.5879 7.01383 numMergedOcc 0
22 mol 183 unq 2 iso 0 dist 5.44125 7.42108 9.81014 4.81807 5.83071 9.93083 numMergedOcc 0
23 mol 183 unq 3 iso 0 dist 5.44125 7.42108 9.81014 7.79648 10.342 7.01383 numMergedOcc 0
24 mol 183 unq 4 iso 0 dist 8.7143 9.19941 9.81014 7.68618 5.83071 9.93083 numMergedOcc 0
25 mol 183 unq 5 iso 0 dist 8.7143 9.19941 9.81014 6.50505 10.342 7.01383 numMergedOcc 0
26 mol 218 unq 0 iso 0 dist 8.61427 8.27907 10.0899 10.2817 15.7679 7.18041 numMergedOcc 0
27 mol 233 unq 0 iso 0 dist 7.74693 7.83363 5.3674 12.3957 12.7167 9.43203 numMergedOcc 0
28 mol 235 unq 0 iso 0 dist 8.92054 8.19915 5.52698 6.84447 8.48065 8.21247 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 9.51177 9.46582 13.1765 9.23693 11.6545 7.67322 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 9.51177 9.77231 14.6367 15.3161 13.609 9.68513 numMergedOcc 0
31 mol 238 unq 2 iso 0 dist 9.51177 9.77231 14.6367 9.18011 10.2894 9.29858 numMergedOcc 0
32 mol 243 unq 0 iso 0 dist 5.86679 8.53888 4.12468 10.3202 10.8489 8.61104 numMergedOcc 0
33 mol 243 unq 1 iso 0 dist 8.28347 9.46855 4.12468 10.1405 10.8489 8.61104 numMergedOcc 0
34 mol 247 unq 0 iso 0 dist 9.65548 9.6455 4.32191 9.44194 10.5086 6.6838 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 5.30455 8.46351 6.58569 5.59901 6.42725 7.76676 numMergedOcc 0
36 mol 259 unq 1 iso 0 dist 7.34794 8.46351 5.63099 5.59901 9.56653 7.76676 numMergedOcc 0
