0 mol 0 unq 0 iso 0 dist 6.44948 6.79669 6.80636 12.3599 9.15248 8.31596 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.37981 10.169 9.23213 10.1803 10.3034 6.3267 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 7.19621 11.8799 9.23213 15.678 10.3034 6.3267 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 6.79478 16.1353 9.53002 14.4856 7.85924 5.43238 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.56737 17.0485 8.89374 22.0835 12.7331 6.96494 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 9.56737 17.0485 8.89374 16.5678 7.05413 7.01363 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 6.6003 5.29079 9.80142 4.97843 4.94316 8.06829 numMergedOcc 0
7 mol 64 unq 1 iso 0 dist 6.6003 5.78769 9.54144 9.14856 5.68303 8.4517 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 9.74996 4.68683 7.04352 7.78321 11.1718 9.70189 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 8.42445 10.453 8.71128 15.2446 9.2907 7.36816 numMergedOcc 0
10 mol 114 unq 1 iso 0 dist 8.64783 7.19662 6.73814 14.6135 12.1324 9.86739 numMergedOcc 0
11 mol 114 unq 2 iso 0 dist 8.64783 7.19662 6.73814 9.84759 6.95201 8.39249 numMergedOcc 0
12 mol 114 unq 3 iso 0 dist 8.64783 7.19662 6.73814 13.8868 5.9968 8.93623 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 8.40046 7.34983 9.81878 8.03243 14.085 6.3244 numMergedOcc 0
14 mol 140 unq 0 iso 0 dist 9.93572 5.36419 7.27371 7.79467 8.17877 5.63811 numMergedOcc 0
15 mol 140 unq 1 iso 0 dist 9.93572 5.36419 7.27371 11.7363 4.6872 7.49546 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 6.42756 9.82776 6.93652 11.288 7.57216 6.2135 numMergedOcc 0
17 mol 155 unq 0 iso 0 dist 7.02715 5.84938 8.87452 5.64806 5.77564 6.51096 numMergedOcc 0
18 mol 155 unq 1 iso 0 dist 7.02715 9.52867 7.68368 5.64806 5.77564 8.73171 numMergedOcc 0
19 mol 156 unq 0 iso 0 dist 8.81169 8.83831 8.47155 13.5937 9.30783 6.90155 numMergedOcc 0
20 mol 156 unq 1 iso 0 dist 7.30021 10.3893 6.27641 11.6317 6.29785 6.90155 numMergedOcc 0
21 mol 156 unq 2 iso 0 dist 9.16591 4.95416 7.55203 8.57453 4.53931 6.90155 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 8.69888 14.6255 9.8589 17.6319 11.0415 4.79852 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 5.08206 11.5085 9.8589 14.1664 11.0415 4.79852 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 6.56437 11.7838 7.06793 14.4755 7.98696 8.89778 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 6.56437 10.4999 6.67585 14.4755 7.98696 9.47554 numMergedOcc 0
26 mol 224 unq 2 iso 0 dist 6.23882 9.57742 7.06793 12.5784 7.98696 8.89778 numMergedOcc 0
27 mol 224 unq 3 iso 0 dist 6.23882 12.0368 6.67585 12.5784 7.98696 9.47554 numMergedOcc 0
28 mol 224 unq 4 iso 0 dist 9.53131 8.30442 7.06793 13.7859 7.98696 8.89778 numMergedOcc 0
29 mol 224 unq 5 iso 0 dist 9.53131 4.63666 6.67585 13.7859 7.98696 9.47554 numMergedOcc 0
30 mol 224 unq 6 iso 0 dist 9.34636 5.46434 7.06793 8.60781 7.98696 8.89778 numMergedOcc 0
31 mol 224 unq 7 iso 0 dist 9.34636 5.03449 6.67585 8.60781 7.98696 9.47554 numMergedOcc 0
32 mol 224 unq 8 iso 0 dist 9.33771 11.498 6.87664 10.8214 9.36098 8.89778 numMergedOcc 0
33 mol 224 unq 9 iso 0 dist 9.33771 11.498 6.87664 6.4508 5.29877 9.47554 numMergedOcc 0
34 mol 224 unq 10 iso 0 dist 9.79616 5.03449 6.65984 8.60781 7.12232 9.47554 numMergedOcc 0
35 mol 234 unq 0 iso 0 dist 5.00515 9.90298 6.16063 10.435 5.9221 8.49841 numMergedOcc 0
36 mol 238 unq 0 iso 0 dist 5.24313 5.27451 7.02475 10.2991 8.82861 6.65088 numMergedOcc 0
37 mol 238 unq 1 iso 0 dist 5.24313 6.23871 7.67322 10.2991 8.82861 6.5772 numMergedOcc 0
38 mol 238 unq 2 iso 0 dist 5.24313 11.3884 7.19008 10.2991 8.82861 6.17025 numMergedOcc 0
39 mol 258 unq 0 iso 0 dist 5.73296 5.28906 6.49982 9.09553 5.95565 7.16259 numMergedOcc 0
40 mol 259 unq 0 iso 0 dist 5.90381 10.8128 7.50578 16.4938 11.5772 8.76313 numMergedOcc 0
41 mol 259 unq 1 iso 0 dist 5.90381 10.8128 7.50578 13.252 7.44916 7.4363 numMergedOcc 0
42 mol 274 unq 0 iso 0 dist 6.00877 4.05661 6.50589 5.42845 5.31116 8.49866 numMergedOcc 0
43 mol 274 unq 1 iso 0 dist 8.66451 7.47324 6.50589 5.62484 5.31116 8.49866 numMergedOcc 0
44 mol 282 unq 0 iso 0 dist 9.12049 5.65144 9.58517 9.69725 5.9438 6.73692 numMergedOcc 0
45 mol 284 unq 0 iso 0 dist 8.10742 4.93259 7.52785 10.7399 7.29657 7.5746 numMergedOcc 0
