0 mol 18 unq 0 iso 0 dist 8.51213 9.7728 15.8027 5.34733 5.65084 13.3023 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.56664 9.1926 9.17877 5.68713 9.69044 13.3351 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 9.58156 9.1926 13.7909 5.68713 6.9103 13.3351 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.32453 8.63792 3.69293 5.22 9.6952 10.9358 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 8.13273 4.81841 4.73066 3.84897 8.27883 4.3439 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 8.13273 4.81841 4.73066 5.78182 5.75428 6.05855 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 8.13273 4.81841 4.73066 12.5746 8.57395 11.1729 numMergedOcc 0
7 mol 95 unq 3 iso 0 dist 8.13273 4.81841 4.73066 16.9294 9.85409 14.5416 numMergedOcc 0
8 mol 95 unq 4 iso 0 dist 8.29852 4.81841 4.20834 3.84897 7.7152 4.3439 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 7.2461 7.59747 6.79448 4.10689 8.49678 9.25023 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 7.55822 6.98134 5.49724 8.3164 8.28795 9.87354 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.29673 6.01995 11.0915 10.2739 8.26547 15.7198 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 7.24965 8.91908 9.58921 3.75935 9.04757 10.4559 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 5.41229 6.3472 4.69387 4.00111 7.06025 9.15383 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.09426 8.78251 4.04122 12.6481 7.2793 9.34653 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.09426 8.78251 4.04122 13.7919 9.51091 10.8711 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 7.09426 8.78251 4.04122 3.97751 7.85184 10.8716 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 7.22234 5.90026 4.71943 12.4111 8.21793 12.7691 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 5.86501 8.86496 4.71943 6.09933 8.21793 12.7691 numMergedOcc 0
19 mol 213 unq 2 iso 0 dist 8.48081 5.90026 3.62097 12.2429 8.22569 10.8822 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 8.95261 9.79593 10.9989 3.84196 8.83833 7.80473 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.70123 9.50155 6.7745 15.3157 9.57499 13.9391 numMergedOcc 0
