0 mol 46 unq 0 iso 0 dist 5.41906 7.19406 4.76522 6.51519 8.89554 7.57749 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.81779 7.55854 11.7708 4.27513 12.2573 5.41774 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.10093 5.48669 3.70978 4.78298 8.31272 5.41774 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 6.46565 5.78051 3.70978 5.26955 8.31272 5.41774 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.65864 9.0101 9.02965 4.05111 10.3895 6.63973 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 6.75212 6.4822 9.27523 6.98797 6.31404 5.56446 numMergedOcc 0
6 mol 144 unq 0 iso 0 dist 6.7211 6.21815 4.28185 6.01619 8.85737 7.46026 numMergedOcc 0
7 mol 144 unq 1 iso 0 dist 6.7211 6.21815 4.28185 3.7983 9.33259 7.94971 numMergedOcc 0
8 mol 146 unq 0 iso 0 dist 9.45306 9.5348 13.9566 8.19476 13.0729 6.93154 numMergedOcc 0
9 mol 146 unq 1 iso 0 dist 9.11691 9.5348 13.0097 8.19476 14.2687 6.93154 numMergedOcc 0
10 mol 146 unq 2 iso 0 dist 8.36855 9.5348 3.96561 8.19476 8.82192 6.93154 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 6.01466 7.83389 7.85772 12.5518 14.978 7.93715 numMergedOcc 0
12 mol 192 unq 1 iso 0 dist 6.01466 9.02212 5.42437 4.53842 7.1329 8.8637 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 5.73488 7.11262 5.21233 8.62768 11.735 9.27308 numMergedOcc 0
14 mol 225 unq 1 iso 0 dist 5.73488 7.11262 5.21233 4.57447 4.58113 7.25438 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 8.45743 6.97966 4.25483 3.86571 11.4896 8.98005 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 7.72115 8.73545 5.5881 14.2672 11.2143 8.7831 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 7.72115 8.73545 5.5881 14.2649 10.1504 9.61071 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 7.72115 8.73545 5.5881 7.83075 5.29501 7.1229 numMergedOcc 0
19 mol 233 unq 3 iso 0 dist 7.72115 8.14581 5.60683 7.83075 5.29501 9.55705 numMergedOcc 0
20 mol 233 unq 4 iso 0 dist 6.43615 8.73545 11.4518 14.2672 16.7991 8.7831 numMergedOcc 0
21 mol 233 unq 5 iso 0 dist 6.43615 8.73545 11.4518 14.2649 15.4586 9.61071 numMergedOcc 0
22 mol 233 unq 6 iso 0 dist 6.43615 8.73545 11.4518 7.83075 8.81206 7.1229 numMergedOcc 0
23 mol 233 unq 7 iso 0 dist 6.43615 8.14581 3.75722 7.83075 8.81206 9.55705 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 9.10682 5.03174 8.12478 4.66338 12.2745 7.19658 numMergedOcc 0
25 mol 264 unq 1 iso 0 dist 7.60952 7.22743 8.12478 10.3972 12.2745 7.19658 numMergedOcc 0
26 mol 270 unq 0 iso 0 dist 7.18305 4.60602 8.32836 4.65147 11.786 6.46935 numMergedOcc 0
27 mol 270 unq 1 iso 0 dist 7.18305 4.60602 8.32836 7.14116 13.1648 5.98384 numMergedOcc 0
