0 mol 8 unq 0 iso 0 dist 9.00925 6.92865 11.3728 9.31461 15.5014 5.96331 6.88402 15.3607 8.99126 10.0164 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.3147 7.84393 10.5285 9.97466 15.257 6.3033 6.31174 14.6162 8.73972 9.62336 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 9.79426 7.84393 9.84922 9.97466 4.78277 6.3033 6.31174 9.04865 8.73972 9.62336 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 8.84148 8.52254 6.73507 7.53194 4.80255 3.53534 6.79455 11.6888 7.41857 9.28732 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.36915 5.36645 8.03277 5.43913 5.44336 3.63758 4.16088 10.2994 8.09058 7.03832 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 8.36915 5.36645 8.03277 8.26877 10.4965 6.88863 4.16088 10.2994 8.09058 7.16443 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 6.01454 5.36645 9.26483 5.43913 9.12054 3.63758 4.16088 9.18584 8.09058 7.03832 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 6.01454 5.36645 9.26483 8.26877 13.688 6.88863 4.16088 9.18584 8.09058 7.16443 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 7.02693 8.69689 3.85805 5.14919 6.4154 5.64598 7.78587 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 5.39171 6.30194 5.2774 7.02693 8.69689 5.17781 5.14919 6.4154 4.65521 7.78587 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.27355 4.24428 9.76331 7.02693 8.0072 3.85805 5.14919 9.51458 5.64598 7.78587 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 9.27355 6.30194 5.44275 7.02693 8.0072 5.17781 5.14919 9.51458 4.65521 7.78587 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 8.60363 4.24428 10.4402 7.02693 9.61302 3.85805 5.14919 10.9127 5.64598 7.78587 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 8.60363 6.30194 8.0624 7.02693 9.61302 5.17781 5.14919 10.9127 4.65521 7.78587 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 8.98151 8.62711 6.75619 9.64136 4.24788 3.97136 13.376 14.869 9.81878 13.5555 numMergedOcc 0
15 mol 140 unq 0 iso 0 dist 9.92335 9.41832 8.78908 7.82005 4.00168 9.54649 6.92517 11.5599 6.95323 11.7311 numMergedOcc 0
16 mol 140 unq 1 iso 0 dist 9.92335 5.44596 4.83408 7.82005 4.00168 4.56057 6.92517 11.5599 7.27371 11.7311 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 8.6609 6.73365 6.15969 8.06007 12.9272 12.5746 7.92448 12.2829 9.0664 15.8157 numMergedOcc 0
18 mol 175 unq 1 iso 0 dist 6.21546 6.73365 5.50014 8.06007 7.97895 12.5746 7.92448 12.616 9.0664 15.8157 numMergedOcc 0
19 mol 175 unq 2 iso 0 dist 6.03184 6.73365 7.28617 8.06007 9.57126 12.5746 7.92448 9.95921 9.0664 15.8157 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 9.81136 8.47248 4.82712 9.59498 9.67136 6.07496 15.9026 6.35728 8.60247 13.0116 numMergedOcc 0
21 mol 214 unq 1 iso 0 dist 7.25293 8.47248 7.84001 9.59498 4.99827 6.07496 15.9026 14.4364 8.60247 13.0116 numMergedOcc 0
22 mol 219 unq 0 iso 0 dist 4.67452 8.09769 10.0509 8.58891 5.15128 10.0702 7.42613 10.719 4.87541 11.5911 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.74214 8.89538 10.4952 8.62485 6.17041 5.7648 13.2905 14.0108 6.77463 8.71877 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 6.74214 8.89538 10.4952 8.62485 6.17041 5.7648 10.4286 15.4111 7.2766 12.5272 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 6.74214 8.89538 10.4952 9.37688 3.90516 9.56124 13.2905 14.0108 6.77463 12.0443 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 6.74214 8.89538 10.4952 9.37688 3.90516 9.56124 10.4286 15.4111 7.2766 15.8661 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 5.33462 8.89538 7.22173 8.62485 4.51854 5.7648 13.2905 9.75691 6.77463 8.71877 numMergedOcc 0
28 mol 238 unq 5 iso 0 dist 5.33462 8.89538 7.22173 8.62485 4.51854 5.7648 10.4286 11.8665 7.2766 12.5272 numMergedOcc 0
29 mol 238 unq 6 iso 0 dist 5.33462 8.89538 7.22173 9.37688 5.3726 9.56124 13.2905 9.75691 6.77463 12.0443 numMergedOcc 0
30 mol 238 unq 7 iso 0 dist 5.33462 8.89538 7.22173 9.37688 5.3726 9.56124 10.4286 11.8665 7.2766 15.8661 numMergedOcc 0
31 mol 253 unq 0 iso 0 dist 9.58767 8.07341 11.4733 9.31626 7.64377 9.46115 14.0411 14.7327 7.19465 15.0416 numMergedOcc 0
32 mol 253 unq 1 iso 0 dist 9.58767 8.07341 11.4733 9.77366 4.87368 10.3603 14.0411 14.7327 7.19465 14.9336 numMergedOcc 0
33 mol 265 unq 0 iso 0 dist 9.56472 7.54805 15.4199 6.18698 12.1988 5.94366 8.3872 13.1262 6.34034 9.47153 numMergedOcc 0
34 mol 265 unq 1 iso 0 dist 6.5072 7.54805 12.4903 6.18698 8.25438 5.94366 8.3872 14.5765 6.34034 9.47153 numMergedOcc 0
35 mol 265 unq 2 iso 0 dist 4.03921 7.54805 5.11366 6.18698 4.75288 5.94366 8.3872 9.01586 6.34034 9.47153 numMergedOcc 0
36 mol 266 unq 0 iso 0 dist 9.58577 7.72749 10.2159 9.32456 3.42311 7.64118 13.5492 18.7065 9.02188 16.4661 numMergedOcc 0
