0 mol 8 unq 0 iso 0 dist 7.91052 9.86938 6.17523 7.08043 11.1789 8.99126 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 5.68841 8.68726 6.13182 10.8906 10.4837 8.24062 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 5.4421 9.75205 8.87368 15.6961 16.0725 9.10189 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 8.27253 9.47892 11.0594 9.58951 12.9497 7.39889 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 8.27253 9.47892 11.0594 18.2257 20.3013 9.63176 numMergedOcc 0
5 mol 119 unq 2 iso 0 dist 8.27253 9.47892 11.0594 9.93013 15.2134 7.44174 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 6.80942 7.50392 7.441 4.94973 5.68636 9.38946 numMergedOcc 0
7 mol 155 unq 1 iso 0 dist 6.80942 8.77391 6.79302 12.7814 13.3396 7.39644 numMergedOcc 0
8 mol 155 unq 2 iso 0 dist 6.80942 8.77391 6.79302 4.94973 5.68636 7.36102 numMergedOcc 0
9 mol 155 unq 3 iso 0 dist 7.49276 7.62575 9.67559 14.7279 18.2685 9.86313 numMergedOcc 0
10 mol 155 unq 4 iso 0 dist 7.49276 7.62575 9.67559 10.4606 15.7513 7.51198 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 9.9855 9.56248 9.82963 8.11337 14.833 7.93331 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 9.9855 9.56248 9.82963 10.8336 15.901 6.98095 numMergedOcc 0
13 mol 173 unq 2 iso 0 dist 9.9855 9.56248 9.82963 10.6484 14.6466 8.31897 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.99964 9.15368 9.91634 9.09989 14.2552 6.94688 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 9.99964 7.96182 13.2318 9.09989 14.2552 6.71012 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 9.14877 6.17129 6.09218 4.3158 9.79901 4.93785 numMergedOcc 0
17 mol 181 unq 3 iso 0 dist 8.18021 6.17129 8.78318 4.3158 11.2136 4.93785 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 9.08655 7.52171 9.59835 10.2633 15.4227 6.47873 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 9.08655 7.52171 9.59835 4.57265 11.6756 8.38695 numMergedOcc 0
20 mol 194 unq 2 iso 0 dist 9.08655 6.289 9.24953 7.72655 13.4484 5.48258 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 9.48833 7.90156 7.85937 11.7195 9.82905 7.17547 numMergedOcc 0
22 mol 218 unq 1 iso 0 dist 9.48833 7.90156 7.85937 4.67327 8.2088 7.13323 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 8.75001 9.94175 11.121 13.8985 12.6391 5.38637 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 8.75001 9.94175 11.121 14.9782 16.5832 6.55759 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 6.75599 8.52504 9.61374 10.5784 15.6212 8.71415 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 9.18345 8.81534 5.58989 5.33567 6.06422 5.38637 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 9.18345 8.81534 5.58989 9.85437 9.6312 6.55759 numMergedOcc 0
28 mol 247 unq 0 iso 0 dist 6.14554 9.76925 10.851 14.6138 17.2395 6.6838 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 9.80725 9.53092 5.4536 4.77548 10.367 7.48005 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 9.80725 9.53092 5.4536 12.7699 8.57619 8.37865 numMergedOcc 0
