0 mol 7 unq 0 iso 0 dist 7.5706 13.6105 8.48947 13.2603 7.58143 8.81608 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.28925 6.88805 8.48947 6.36911 7.58143 8.81608 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.70159 13.156 8.48947 9.36807 7.58143 8.81608 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 7.47201 7.11305 9.88451 13.2086 17.9787 9.06516 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 7.47201 7.11305 9.88451 6.73162 7.38466 9.96121 numMergedOcc 0
5 mol 29 unq 0 iso 0 dist 9.15151 6.37468 4.8437 13.37 8.20627 7.08841 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 9.44189 4.55481 6.74143 10.4347 6.48388 5.91068 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 7.73058 9.06034 6.15557 12.4875 7.20037 5.88159 numMergedOcc 0
8 mol 86 unq 1 iso 0 dist 7.73058 9.06034 6.15557 10.7444 5.51115 9.29889 numMergedOcc 0
9 mol 86 unq 2 iso 0 dist 6.81209 5.9022 6.15557 7.79359 7.20037 5.88159 numMergedOcc 0
10 mol 86 unq 3 iso 0 dist 6.81209 5.9022 6.15557 10.5799 5.51115 9.29889 numMergedOcc 0
11 mol 86 unq 4 iso 0 dist 8.54122 4.49936 6.15557 10.3067 7.20037 5.88159 numMergedOcc 0
12 mol 86 unq 5 iso 0 dist 8.54122 4.49936 6.15557 13.0518 5.51115 9.29889 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 9.46004 6.4559 8.92441 10.2871 4.96936 6.88846 numMergedOcc 0
14 mol 157 unq 0 iso 0 dist 7.02823 9.13808 7.98849 9.97573 5.16713 6.4431 numMergedOcc 0
15 mol 157 unq 1 iso 0 dist 8.97404 10.308 7.98849 11.5477 5.16713 6.4431 numMergedOcc 0
16 mol 157 unq 2 iso 0 dist 6.8364 10.308 7.30209 11.5477 5.78862 6.4431 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 5.08591 5.00913 8.2071 9.31887 9.19032 9.76114 numMergedOcc 0
18 mol 175 unq 1 iso 0 dist 8.03727 11.1374 8.2071 12.816 9.19032 9.76114 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 8.29133 10.1881 8.52247 6.0965 10.4683 8.65196 numMergedOcc 0
20 mol 213 unq 1 iso 0 dist 8.29133 10.1881 8.52247 9.59129 8.3461 5.461 numMergedOcc 0
21 mol 213 unq 2 iso 0 dist 8.96646 13.4142 8.52247 11.5105 10.4683 8.65196 numMergedOcc 0
22 mol 213 unq 3 iso 0 dist 8.96646 13.4142 8.52247 13.8919 8.3461 5.461 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 6.83371 8.08444 6.05616 12.4923 7.18399 6.15777 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 7.72403 5.53885 9.18416 10.3388 10.0213 8.27411 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 7.72403 5.53885 9.18416 6.25105 6.81789 7.36208 numMergedOcc 0
26 mol 234 unq 2 iso 0 dist 6.35438 3.95629 9.18416 9.5707 10.0213 8.27411 numMergedOcc 0
27 mol 234 unq 3 iso 0 dist 6.35438 3.95629 9.18416 7.85175 6.81789 7.36208 numMergedOcc 0
28 mol 234 unq 4 iso 0 dist 9.57132 12.8018 9.18416 11.8897 10.0213 8.27411 numMergedOcc 0
29 mol 234 unq 5 iso 0 dist 9.57132 12.8018 9.18416 13.0678 6.81789 7.36208 numMergedOcc 0
30 mol 270 unq 0 iso 0 dist 8.34847 4.52348 6.65704 10.3858 4.23786 9.51462 numMergedOcc 0
31 mol 270 unq 1 iso 0 dist 8.34847 3.87381 7.33514 10.3858 4.23786 8.12971 numMergedOcc 0
32 mol 270 unq 2 iso 0 dist 9.73905 10.8041 6.65704 13.3096 4.23786 9.51462 numMergedOcc 0
33 mol 270 unq 3 iso 0 dist 9.73905 10.9318 7.33514 13.3096 4.23786 8.12971 numMergedOcc 0
