0 mol 8 unq 0 iso 0 dist 9.00925 9.95165 14.4767 16.9454 20.4953 7.12263 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.00925 9.95165 14.4767 8.95363 14.1033 5.00267 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 7.3489 9.09854 5.41302 4.02014 8.26327 8.38836 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.50382 9.23617 4.20374 6.57527 10.596 7.69625 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 8.76559 8.59114 4.20374 8.42839 10.596 7.69625 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 9.3147 8.75332 4.99617 4.93362 8.41365 7.69625 numMergedOcc 0
6 mol 19 unq 3 iso 0 dist 9.79426 8.75332 13.9869 4.93362 12.6305 7.69625 numMergedOcc 0
7 mol 55 unq 0 iso 0 dist 9.30367 7.43154 11.6572 8.45629 16.1834 6.13181 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.27331 8.91206 6.28525 16.3838 13.4403 8.58543 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.328 8.67513 5.9876 10.3777 7.95383 8.58543 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 6.328 9.12738 3.69759 10.3777 7.95383 8.99433 numMergedOcc 0
11 mol 105 unq 0 iso 0 dist 8.80388 5.74652 9.68577 6.99759 12.8286 8.44437 numMergedOcc 0
12 mol 105 unq 1 iso 0 dist 7.28156 5.74652 7.14906 6.99759 12.7846 8.44437 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 7.02969 7.35503 7.99528 6.80122 13.2059 9.74569 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 7.02265 8.79543 7.99528 7.8709 13.2059 9.74569 numMergedOcc 0
15 mol 112 unq 2 iso 0 dist 9.42175 6.48223 7.99528 11.9632 13.2059 9.74569 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 7.64085 6.93136 6.07527 6.36527 9.07229 5.73236 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 7.71277 9.19078 10.4193 6.79236 12.0246 6.39031 numMergedOcc 0
18 mol 163 unq 0 iso 0 dist 9.85967 6.96572 5.82796 12.2679 13.6629 8.23605 numMergedOcc 0
19 mol 163 unq 1 iso 0 dist 9.85967 9.29539 10.8136 4.2381 11.3472 7.3546 numMergedOcc 0
20 mol 171 unq 0 iso 0 dist 9.47945 6.81707 10.6959 15.0267 19.9643 9.75627 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 9.45817 4.97005 10.763 10.0516 10.5074 7.55358 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 9.45817 4.97005 10.763 5.57831 9.39664 7.60991 numMergedOcc 0
23 mol 186 unq 2 iso 0 dist 9.45817 7.22 8.60943 10.0516 10.5074 8.87818 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 8.44004 8.23919 5.18278 9.05333 11.6289 8.93185 numMergedOcc 0
25 mol 218 unq 1 iso 0 dist 8.44004 8.23919 5.18278 6.45289 11.6935 8.22792 numMergedOcc 0
26 mol 235 unq 0 iso 0 dist 7.38609 9.08444 4.73244 3.94313 7.22411 6.89118 numMergedOcc 0
27 mol 251 unq 0 iso 0 dist 8.65339 5.0953 4.20853 3.92576 11.8157 8.53757 numMergedOcc 0
28 mol 281 unq 0 iso 0 dist 6.7897 7.86146 9.96217 6.7978 11.9956 4.95189 numMergedOcc 0
