0 mol 1 unq 0 iso 0 dist 6.06669 7.20594 6.35294 13.5153 8.69605 14.1655 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 3.71928 7.1431 5.10609 6.1339 8.01055 11.0194 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 3.71928 7.1431 5.10609 6.48158 8.61976 9.60177 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.0009 9.51572 6.48377 6.74022 8.52643 13.5408 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 8.0009 9.51572 6.48377 5.42653 9.75299 12.831 numMergedOcc 0
5 mol 64 unq 2 iso 0 dist 8.91298 9.51572 11.9543 6.74022 5.41357 13.5408 numMergedOcc 0
6 mol 64 unq 3 iso 0 dist 8.91298 9.51572 11.9543 5.42653 9.30042 12.831 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 6.57749 4.52009 7.28199 9.09097 6.12267 11.1591 numMergedOcc 0
8 mol 67 unq 1 iso 0 dist 6.57749 4.52009 7.28199 7.29064 8.43162 11.3283 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 5.72494 6.13194 11.0116 5.40051 7.66418 10.6894 numMergedOcc 0
10 mol 103 unq 1 iso 0 dist 8.70106 6.13194 13.5214 5.40051 8.078 10.6894 numMergedOcc 0
11 mol 103 unq 2 iso 0 dist 8.70106 6.13194 13.5214 14.0531 6.56481 18.265 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 9.15982 9.03707 4.45081 11.2753 6.54778 10.451 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.58344 6.61966 5.81849 5.49967 9.84762 9.53895 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 5.68879 6.61966 5.7998 5.49967 5.2184 9.53895 numMergedOcc 0
15 mol 124 unq 0 iso 0 dist 6.31232 9.69841 11.0785 8.28232 7.18976 16.8616 numMergedOcc 0
16 mol 132 unq 0 iso 0 dist 9.10144 9.7097 5.6296 5.36829 6.94745 10.1299 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 4.46578 6.90904 6.63023 10.008 8.76088 14.5752 numMergedOcc 0
18 mol 148 unq 0 iso 0 dist 8.60157 6.81055 13.8725 6.76353 8.6953 13.2422 numMergedOcc 0
19 mol 148 unq 1 iso 0 dist 6.72591 6.81055 11.2206 6.76353 9.18753 13.2422 numMergedOcc 0
20 mol 150 unq 0 iso 0 dist 8.59359 6.77966 13.845 6.65519 8.65967 13.1275 numMergedOcc 0
21 mol 150 unq 1 iso 0 dist 6.80192 6.77966 11.1844 6.65519 9.15244 13.1275 numMergedOcc 0
22 mol 182 unq 0 iso 0 dist 7.03216 5.16184 4.39505 4.60682 8.27913 8.63031 numMergedOcc 0
23 mol 182 unq 1 iso 0 dist 9.42196 5.16184 11.2827 4.60682 8.85111 8.63031 numMergedOcc 0
24 mol 189 unq 0 iso 0 dist 9.71306 9.22035 17.3417 7.19635 9.95686 15.6446 numMergedOcc 0
25 mol 189 unq 1 iso 0 dist 9.71306 9.22035 17.3417 8.18227 9.47321 15.6211 numMergedOcc 0
26 mol 189 unq 2 iso 0 dist 9.20296 9.22035 14.0791 8.18227 6.38294 15.6211 numMergedOcc 0
27 mol 220 unq 0 iso 0 dist 5.2376 8.77267 9.16344 7.16053 6.80214 15.0534 numMergedOcc 0
28 mol 220 unq 1 iso 0 dist 7.66083 9.81907 12.2375 6.48083 5.25149 13.8075 numMergedOcc 0
29 mol 220 unq 2 iso 0 dist 7.66083 9.81907 12.2375 6.54824 8.6368 6.25503 numMergedOcc 0
30 mol 226 unq 0 iso 0 dist 7.6174 6.93858 11.8711 5.92917 8.74399 11.876 numMergedOcc 0
31 mol 250 unq 0 iso 0 dist 9.73318 8.95513 11.7643 4.11548 8.51703 8.98805 numMergedOcc 0
32 mol 250 unq 1 iso 0 dist 5.75551 8.95513 5.64152 4.11548 5.07895 8.98805 numMergedOcc 0
33 mol 272 unq 0 iso 0 dist 9.10712 7.37973 14.5292 7.57685 7.90763 14.467 numMergedOcc 0
34 mol 282 unq 0 iso 0 dist 6.15396 7.89956 4.44911 5.668 5.00258 8.79823 numMergedOcc 0
35 mol 282 unq 1 iso 0 dist 6.15396 7.89956 4.44911 8.54733 9.98886 12.4603 numMergedOcc 0
36 mol 282 unq 2 iso 0 dist 9.18964 7.89956 9.11051 5.668 8.22117 8.79823 numMergedOcc 0
37 mol 282 unq 3 iso 0 dist 9.18964 7.89956 9.11051 8.54733 6.81887 12.4603 numMergedOcc 0
38 mol 284 unq 0 iso 0 dist 5.62295 9.86647 15.479 10.8669 7.74965 19.1893 numMergedOcc 0
39 mol 293 unq 0 iso 0 dist 6.02106 9.50932 6.64058 6.26633 7.41524 8.98365 numMergedOcc 0
40 mol 293 unq 1 iso 0 dist 8.27274 9.50932 10.2071 6.26633 6.42608 8.98365 numMergedOcc 0
