0 mol 8 unq 0 iso 0 dist 7.45487 5.43751 9.62879 9.49106 8.4069 8.96553 8.69023 13.3876 8.27181 8.33604 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 5.84479 5.35079 6.31718 9.18436 6.92781 5.05803 5.1298 5.47769 6.2983 7.03948 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 5.84479 6.53177 7.63133 8.67719 5.32694 5.46498 5.1298 5.47769 5.94084 6.58035 numMergedOcc 0
3 mol 16 unq 2 iso 0 dist 5.84479 6.53177 7.63133 8.67719 5.32694 5.46498 13.18 13.0191 6.73355 8.41862 numMergedOcc 0
4 mol 16 unq 3 iso 0 dist 5.84479 6.53177 7.63133 13.4596 10.4155 8.71745 13.18 13.0191 6.73355 8.16785 numMergedOcc 0
5 mol 16 unq 4 iso 0 dist 8.67719 6.53177 5.46498 5.84479 5.32694 7.63133 5.1298 6.58035 5.94084 5.47769 numMergedOcc 0
6 mol 16 unq 5 iso 0 dist 8.67719 6.53177 5.46498 13.4596 5.74188 8.71745 13.18 8.41862 6.73355 8.16785 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 9.90845 9.59761 8.86116 10.6042 10.0952 6.86014 8.08994 12.4274 5.39241 9.75144 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 7.84983 11.5882 6.62496 12.9335 5.30792 6.86465 17.0485 11.5023 6.47744 8.63333 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 7.84983 11.5882 6.62496 9.56737 4.81926 6.35756 17.0485 11.5023 6.47744 8.89374 numMergedOcc 0
10 mol 58 unq 2 iso 0 dist 9.56737 11.5882 6.35756 12.9335 5.35073 6.86465 17.0485 8.89374 6.47744 8.63333 numMergedOcc 0
11 mol 58 unq 3 iso 0 dist 9.56737 11.5882 6.35756 7.84983 4.81926 6.62496 11.5448 9.66798 4.67832 9.64665 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.514 11.8037 7.4729 13.0248 8.95922 6.82344 5.02124 5.81965 6.99832 9.70512 numMergedOcc 0
13 mol 117 unq 0 iso 0 dist 7.70533 14.3476 7.90328 14.7579 7.22206 7.83136 12.4058 6.62561 4.91401 7.63616 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 8.97145 14.257 6.85062 14.5129 6.63273 7.12972 10.4276 6.91348 6.19596 8.6243 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 6.5874 7.60371 6.85062 11.4628 6.63273 7.12972 4.96935 6.91348 6.19596 8.6243 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.11955 7.96098 6.80239 11.5405 7.79672 8.00618 17.2912 15.1694 12.2037 7.92688 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 7.78849 11.454 9.89303 11.4625 5.79898 6.54501 17.8858 12.0514 10.1448 8.6355 numMergedOcc 0
18 mol 142 unq 0 iso 0 dist 7.57458 13.1936 9.2313 10.5524 5.32922 5.31024 5.81429 7.15475 9.49653 9.07935 numMergedOcc 0
19 mol 142 unq 1 iso 0 dist 7.57458 12.288 7.73169 10.5524 5.32922 7.26382 5.81429 7.15475 7.53854 9.07935 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 9.74498 10.7816 8.67331 13.0082 6.4896 6.70283 14.8436 14.1119 8.25411 9.13561 numMergedOcc 0
21 mol 152 unq 1 iso 0 dist 9.74498 7.26476 8.05741 13.0082 6.4896 7.16148 14.8436 14.1119 7.89109 9.13561 numMergedOcc 0
22 mol 156 unq 0 iso 0 dist 6.71202 5.70205 7.66148 10.0734 10.1658 8.94056 7.02779 10.9818 8.67156 6.27641 numMergedOcc 0
23 mol 156 unq 1 iso 0 dist 9.16591 9.27577 9.83699 13.6067 8.38403 7.44554 4.95416 7.55203 6.29785 9.36805 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 8.69888 11.5099 9.0018 14.9263 7.42466 7.652 14.6255 9.8589 8.22779 7.24908 numMergedOcc 0
25 mol 175 unq 1 iso 0 dist 8.69888 5.50014 5.6234 14.9263 7.42466 9.92231 14.6255 9.8589 10.5631 7.24908 numMergedOcc 0
26 mol 175 unq 2 iso 0 dist 5.08206 12.1783 9.0018 11.7895 7.42466 7.652 11.5085 9.8589 8.22779 7.24908 numMergedOcc 0
27 mol 175 unq 3 iso 0 dist 5.08206 7.28617 5.6234 11.7895 7.42466 9.92231 11.5085 9.8589 10.5631 7.24908 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 7.44191 9.60754 8.03334 18.07 13.2049 9.1374 14.6692 12.1309 6.25083 6.94688 numMergedOcc 0
29 mol 181 unq 1 iso 0 dist 7.44191 9.60754 8.03334 18.07 13.2049 9.1374 14.2587 12.2058 4.77278 6.71012 numMergedOcc 0
30 mol 181 unq 2 iso 0 dist 6.00053 11.1879 8.03334 16.1735 13.2049 9.1374 13.2672 12.1309 6.25083 6.94688 numMergedOcc 0
31 mol 181 unq 3 iso 0 dist 6.00053 11.1879 8.03334 16.1735 13.2049 9.1374 15.4116 12.2058 4.77278 6.71012 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 6.56437 14.2632 8.95269 9.2491 4.70378 6.57273 10.4999 6.67585 5.29877 6.65984 numMergedOcc 0
33 mol 224 unq 1 iso 0 dist 6.23882 15.0038 8.95269 10.6031 4.70378 6.57273 12.0368 6.67585 5.29877 6.65984 numMergedOcc 0
34 mol 224 unq 2 iso 0 dist 9.53131 9.59595 8.95269 10.7064 4.70378 6.57273 4.63666 6.67585 5.29877 6.65984 numMergedOcc 0
35 mol 224 unq 3 iso 0 dist 9.34636 5.63485 8.95269 9.79616 4.70378 6.57273 5.03449 6.67585 5.29877 6.65984 numMergedOcc 0
36 mol 224 unq 4 iso 0 dist 7.39839 4.91322 6.60589 9.33771 5.0744 6.57273 11.498 10.8259 7.12232 6.87664 numMergedOcc 0
37 mol 224 unq 5 iso 0 dist 7.39839 12.979 9.16166 9.33771 5.0744 5.78342 11.498 10.8259 5.3621 6.87664 numMergedOcc 0
38 mol 224 unq 6 iso 0 dist 9.79616 5.63485 6.57273 9.34636 4.70378 8.95269 5.46434 10.0414 9.36098 7.06793 numMergedOcc 0
39 mol 224 unq 7 iso 0 dist 9.79616 5.63485 6.57273 9.34636 4.70378 8.95269 5.03449 6.65984 5.29877 6.67585 numMergedOcc 0
40 mol 224 unq 8 iso 0 dist 9.29703 4.8786 5.78342 12.8171 11.5372 8.95269 11.0842 12.7072 9.36098 7.06793 numMergedOcc 0
41 mol 224 unq 9 iso 0 dist 9.29703 4.8786 5.78342 12.8171 11.5372 8.95269 7.05732 10.667 5.29877 6.67585 numMergedOcc 0
42 mol 224 unq 10 iso 0 dist 9.29703 4.8786 5.78342 11.1052 8.49799 6.57273 7.05732 10.667 5.29877 6.65984 numMergedOcc 0
43 mol 224 unq 11 iso 0 dist 9.29703 7.18448 9.16166 11.1052 8.49799 6.60589 7.05732 10.667 6.12232 6.65984 numMergedOcc 0
44 mol 236 unq 0 iso 0 dist 9.10613 6.0258 8.04248 12.9448 7.43758 8.35971 10.3827 10.6445 6.40312 7.17676 numMergedOcc 0
45 mol 236 unq 1 iso 0 dist 9.10613 6.0258 8.04248 12.9448 7.43758 8.35971 12.2148 10.5433 6.2568 6.68463 numMergedOcc 0
46 mol 238 unq 0 iso 0 dist 5.24313 12.1448 7.31233 10.2654 5.34096 6.22714 11.3884 7.19008 5.17471 7.49471 numMergedOcc 0
47 mol 259 unq 0 iso 0 dist 6.77279 5.71237 8.13497 9.58006 4.69778 7.88519 15.1483 10.9591 11.6195 7.48005 numMergedOcc 0
48 mol 272 unq 0 iso 0 dist 9.1118 6.72149 8.46116 10.342 5.40809 8.33638 11.5698 9.09992 5.63139 6.73206 numMergedOcc 0
49 mol 272 unq 1 iso 0 dist 6.94346 9.58279 8.33638 11.7245 5.40809 8.46116 5.40622 6.73206 5.63139 9.09992 numMergedOcc 0
50 mol 272 unq 2 iso 0 dist 6.94346 9.58279 8.33638 11.7245 5.40809 8.46116 14.4079 10.1966 8.52877 6.16449 numMergedOcc 0
