0 mol 5 unq 0 iso 0 dist 5.04052 4.69173 5.2392 5.80953 9.13355 8.54255 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.87863 11.6381 5.2392 7.18062 9.13355 8.54255 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 9.21811 8.69745 6.56549 13.8759 9.53382 10.4277 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 6.86391 11.0716 7.61923 4.77947 5.87258 11.0602 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 6.86391 7.93542 5.11941 4.77947 5.87258 6.3575 numMergedOcc 0
5 mol 44 unq 2 iso 0 dist 6.86391 4.61354 5.84744 4.77947 5.87258 5.73343 numMergedOcc 0
6 mol 44 unq 3 iso 0 dist 6.86391 6.95649 7.7864 4.77947 5.87258 3.97557 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 4.61355 11.6888 7.57749 8.39995 6.03151 7.35107 numMergedOcc 0
8 mol 46 unq 1 iso 0 dist 4.61355 5.79552 8.55202 8.39995 6.03151 8.85515 numMergedOcc 0
9 mol 48 unq 0 iso 0 dist 6.56383 6.41876 5.41774 4.87992 8.63743 8.12928 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 9.91835 12.2694 5.33961 15.6979 6.74197 8.19607 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 9.91835 6.24264 9.29816 15.6979 6.74197 13.8287 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 9.91835 12.5185 5.08983 15.6979 6.74197 4.67787 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 9.29532 11.7413 7.34638 8.84391 4.79891 11.1108 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 9.29532 12.9428 6.0995 8.84391 4.79891 9.17639 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 7.6935 12.6877 5.33961 10.991 6.74197 8.19607 numMergedOcc 0
16 mol 98 unq 6 iso 0 dist 7.6935 11.6464 9.29816 10.991 6.74197 13.8287 numMergedOcc 0
17 mol 98 unq 7 iso 0 dist 7.6935 6.39965 5.08983 10.991 6.74197 4.67787 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 7.79263 5.20786 5.90003 5.97569 6.88175 7.49885 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 8.61511 11.6041 9.13697 3.94348 6.41759 12.0027 numMergedOcc 0
20 mol 144 unq 0 iso 0 dist 7.83328 11.229 7.46026 5.88067 6.03283 12.3102 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 8.83844 7.58118 6.51523 9.37758 8.09699 12.1824 numMergedOcc 0
22 mol 171 unq 1 iso 0 dist 7.34154 6.25206 6.76574 4.82527 9.38425 5.67061 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.97859 6.89134 6.96382 10.2699 5.41453 5.12308 numMergedOcc 0
24 mol 247 unq 0 iso 0 dist 5.97717 12.9101 9.01651 9.2034 5.52484 8.53302 numMergedOcc 0
25 mol 247 unq 1 iso 0 dist 5.97717 7.97824 8.83903 9.2034 5.52484 9.26852 numMergedOcc 0
26 mol 285 unq 0 iso 0 dist 7.63933 6.61129 8.27917 5.091 9.26793 10.8233 numMergedOcc 0
