0 mol 19 unq 0 iso 0 dist 9.50382 9.23617 4.20374 8.6541 8.76559 8.59114 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 9.50382 9.23617 4.20374 13.4477 10.8249 8.63204 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.76559 8.59114 4.20374 8.6541 9.50382 9.23617 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.76559 8.59114 4.20374 16.76 10.8249 8.63204 numMergedOcc 0
4 mol 51 unq 0 iso 0 dist 9.4097 9.42071 7.2168 16.8715 17.1249 9.97973 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 6.67079 7.66471 5.41761 12.0662 13.2349 8.05787 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 7.14636 7.66471 9.8912 12.0662 16.6966 8.05787 numMergedOcc 0
7 mol 55 unq 2 iso 0 dist 8.07849 8.05787 7.039 12.0662 14.5694 7.66471 numMergedOcc 0
8 mol 60 unq 0 iso 0 dist 9.54864 8.4928 10.5228 9.90603 15.549 7.4674 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.27331 8.91206 6.28525 12.4475 14.6779 8.67513 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 6.328 8.67513 5.9876 12.4475 13.5271 8.91206 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 7.02969 7.35503 7.99528 4.22711 7.02265 8.79543 numMergedOcc 0
12 mol 112 unq 1 iso 0 dist 7.02969 7.35503 7.99528 10.5302 9.42175 6.48223 numMergedOcc 0
13 mol 112 unq 2 iso 0 dist 7.02265 8.79543 7.99528 4.22711 7.02969 7.35503 numMergedOcc 0
14 mol 112 unq 3 iso 0 dist 7.02265 8.79543 7.99528 9.00066 9.42175 6.48223 numMergedOcc 0
15 mol 112 unq 4 iso 0 dist 9.42175 6.48223 7.99528 10.5302 7.02969 7.35503 numMergedOcc 0
16 mol 112 unq 5 iso 0 dist 9.42175 6.48223 7.99528 9.00066 7.02265 8.79543 numMergedOcc 0
17 mol 130 unq 0 iso 0 dist 7.9663 4.85559 4.79695 5.84182 6.54338 6.87562 numMergedOcc 0
18 mol 130 unq 1 iso 0 dist 6.54338 6.87562 4.79695 5.84182 7.9663 4.85559 numMergedOcc 0
19 mol 130 unq 2 iso 0 dist 9.39135 6.87562 8.11667 5.84182 10.0434 4.85559 numMergedOcc 0
20 mol 163 unq 0 iso 0 dist 9.85967 9.29539 10.8136 15.2428 14.995 9.02124 numMergedOcc 0
21 mol 188 unq 0 iso 0 dist 9.98092 8.8513 7.16694 8.75579 13.0136 9.53031 numMergedOcc 0
22 mol 207 unq 0 iso 0 dist 8.84785 9.22778 11.2432 6.28447 13.5588 7.21449 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 9.70222 6.40153 7.25156 6.43452 9.71882 6.20912 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 9.71882 6.20912 7.25156 6.43452 9.70222 6.40153 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 9.58577 7.25797 5.75478 4.67106 9.56469 6.03938 numMergedOcc 0
26 mol 266 unq 1 iso 0 dist 9.56469 6.03938 5.75478 4.67106 9.58577 7.25797 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 7.319 7.88343 9.1711 6.22487 12.6224 7.5355 numMergedOcc 0
28 mol 279 unq 1 iso 0 dist 5.78017 7.5355 7.91886 6.22487 6.12742 7.88343 numMergedOcc 0
29 mol 279 unq 2 iso 0 dist 6.12742 7.88343 7.91886 6.22487 5.78017 7.5355 numMergedOcc 0
30 mol 279 unq 3 iso 0 dist 9.45886 7.88343 12.8975 6.22487 10.7201 7.5355 numMergedOcc 0
31 mol 279 unq 4 iso 0 dist 8.78203 7.5355 9.00832 6.22487 13.8375 7.88343 numMergedOcc 0
32 mol 281 unq 0 iso 0 dist 6.7897 7.86146 9.96217 7.20467 10.2015 6.67705 numMergedOcc 0
33 mol 282 unq 0 iso 0 dist 8.61456 6.91282 6.85098 5.92133 8.41041 5.51953 numMergedOcc 0
34 mol 282 unq 1 iso 0 dist 8.41041 5.51953 6.85098 5.92133 8.61456 6.91282 numMergedOcc 0
