0 mol 30 unq 0 iso 0 dist 7.74629 7.10496 4.26039 6.55665 10.3774 6.87277 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.99735 6.77802 9.165 3.42062 7.90416 9.05737 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 9.7516 9.48328 13.4515 8.11968 12.4931 8.65524 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 9.7516 9.48328 13.4515 12.3188 18.5842 8.96151 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 9.7516 9.48328 13.4515 9.72788 16.4784 9.02535 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.30202 7.49792 7.90686 3.70802 7.01397 4.46067 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 6.00684 6.29267 4.15002 6.02092 6.64921 4.15789 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.37034 8.15861 4.8069 3.81285 8.67342 6.67137 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 9.37034 8.15861 4.8069 6.17121 8.60062 7.04244 numMergedOcc 0
9 mol 85 unq 2 iso 0 dist 9.37034 9.27814 17.0484 11.9486 20.1157 4.18248 numMergedOcc 0
10 mol 85 unq 3 iso 0 dist 6.60091 8.15861 10.0178 3.81285 5.73739 6.67137 numMergedOcc 0
11 mol 85 unq 4 iso 0 dist 6.60091 8.15861 10.0178 6.17121 5.16225 7.04244 numMergedOcc 0
12 mol 85 unq 5 iso 0 dist 6.60091 9.27814 14.189 11.9486 17.465 4.18248 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 9.69413 6.77993 6.65219 3.79142 7.01987 5.24346 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 5.58346 6.98134 8.89777 4.26914 9.53338 6.55227 numMergedOcc 0
15 mol 116 unq 1 iso 0 dist 7.09179 6.98134 12.5145 4.26914 10.966 6.55227 numMergedOcc 0
16 mol 116 unq 2 iso 0 dist 6.24768 8.55413 8.89777 9.53399 9.53338 6.55227 numMergedOcc 0
17 mol 116 unq 3 iso 0 dist 9.31875 8.55413 12.5145 9.53399 10.966 6.55227 numMergedOcc 0
18 mol 176 unq 0 iso 0 dist 7.36833 8.00223 11.2094 3.84631 9.60931 6.85902 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.46821 6.45095 12.8448 6.41178 14.3949 7.83831 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 7.91999 8.7499 5.38659 5.97893 8.18379 9.80479 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 8.65743 5.28746 4.39553 9.23405 9.90506 6.96692 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 8.65743 5.28746 4.39553 11.313 8.61077 8.25286 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 8.65743 5.28746 4.39553 13.005 9.11585 9.9965 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 8.02607 5.28746 3.94797 9.23405 9.03341 6.96692 numMergedOcc 0
25 mol 266 unq 4 iso 0 dist 8.02607 5.28746 3.94797 11.313 10.9833 8.25286 numMergedOcc 0
26 mol 266 unq 5 iso 0 dist 8.02607 5.28746 3.94797 13.005 12.7605 9.9965 numMergedOcc 0
27 mol 281 unq 0 iso 0 dist 7.90993 7.43535 12.4082 3.86368 9.39268 7.90368 numMergedOcc 0
28 mol 283 unq 0 iso 0 dist 8.57375 7.17276 7.97597 6.30031 12.8647 7.31132 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 4.75392 8.15636 5.15725 11.4888 7.82157 6.24487 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 8.61667 8.15636 7.46917 11.4888 10.3879 6.24487 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 4.75392 8.15636 5.15725 11.4888 7.82157 6.24487 numMergedOcc 0
32 mol 288 unq 1 iso 0 dist 8.61667 8.15636 7.46917 11.4888 10.3879 6.24487 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 4.75392 8.15636 5.15725 11.4888 7.82157 6.24487 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 8.61667 8.15636 7.46917 11.4888 10.3879 6.24487 numMergedOcc 0
