0 mol 7 unq 0 iso 0 dist 5.51421 4.7739 5.99459 13.5184 12.2041 9.67164 10.662 11.9621 8.75346 7.15434 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.91301 13.8883 9.01112 15.6504 6.23795 7.62333 11.375 6.4754 4.67793 7.3795 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.609 3.65941 6.74179 9.44073 5.34368 6.07517 4.64354 6.83481 6.01658 9.28932 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 8.609 3.65941 6.74179 9.44073 5.34368 6.07517 10.5178 11.534 8.34136 7.53042 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 5.47319 4.69809 5.99857 9.8809 8.99811 6.9362 8.50061 11.7488 6.98976 7.62791 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.06168 10.8798 5.61588 15.4463 8.07446 5.5087 14.6227 10.8051 6.52486 8.16299 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.06168 10.8798 5.61588 15.4463 8.07446 5.5087 21.1782 13.7608 13.0059 8.27015 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.06168 13.7267 7.83244 15.4463 8.07446 6.08682 14.6227 10.8051 10.9731 8.16299 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 8.06168 13.7267 7.83244 15.4463 8.07446 6.08682 21.1782 13.7608 14.1533 8.27015 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 8.67532 10.8441 5.61588 12.1964 8.07446 5.5087 10.8929 10.8051 6.52486 8.16299 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 8.67532 10.8441 5.61588 12.1964 8.07446 5.5087 13.4503 13.7608 13.0059 8.27015 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 8.67532 15.2203 7.83244 12.1964 8.07446 6.08682 10.8929 10.8051 10.9731 8.16299 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 8.67532 15.2203 7.83244 12.1964 8.07446 6.08682 13.4503 13.7608 14.1533 8.27015 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 8.58841 16.3337 9.85905 17.86 10.2879 6.72869 13.4991 5.56964 6.65453 8.41567 numMergedOcc 0
14 mol 76 unq 1 iso 0 dist 8.58841 16.3337 9.85905 17.86 10.2879 6.72869 21.0826 12.885 7.15288 6.62246 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 5.02717 12.6105 9.42082 12.5189 7.69052 6.39384 15.9634 12.9647 7.34308 8.97043 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 5.63005 9.93257 7.64052 11.5865 17.5132 12.6962 8.62648 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 8.44385 5.92411 6.99446 5.63005 4.85907 7.64052 11.5865 11.5266 12.6962 8.62648 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 9.92932 3.76211 7.21868 9.60411 5.49782 7.93372 13.5049 12.3933 12.487 7.27598 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 9.60369 4.63732 9.66543 12.1043 10.7144 7.93372 17.0182 16.7211 12.487 7.27598 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 9.55556 4.63732 7.21868 12.1043 5.49782 7.93372 17.0182 12.3933 12.487 7.27598 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.58911 17.3349 8.59874 9.86845 6.01247 9.76212 7.56512 6.58792 11.9701 8.90247 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 9.84952 9.77747 9.01624 13.0935 11.5866 5.05973 13.0125 13.2054 5.68795 9.18245 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 7.0843 3.5359 8.75536 6.9398 6.17651 6.67404 6.7488 9.89546 6.13691 4.851 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 7.73315 3.5359 7.33709 6.9398 5.61978 6.67404 6.7488 9.66527 6.13691 4.851 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 7.36905 3.63202 5.90924 9.43335 7.07277 5.90058 7.18658 10.4883 4.97003 6.85672 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 6.83408 3.63202 9.58916 9.43335 14.3597 5.90058 7.18658 13.9604 4.97003 6.85672 numMergedOcc 0
