0 mol 30 unq 0 iso 0 dist 8.64082 8.609 7.18789 3.65941 5.36413 6.74179 9.44073 5.17518 5.34368 6.07517 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.88786 7.51075 7.1369 6.56256 6.37273 7.39665 14.0352 8.66168 14.224 9.8703 numMergedOcc 0
2 mol 110 unq 0 iso 0 dist 5.43052 8.181 9.01856 10.3403 9.24252 16.0464 16.235 12.3557 19.2368 8.49678 numMergedOcc 0
3 mol 162 unq 0 iso 0 dist 8.77869 8.25167 6.71523 13.5522 9.95076 16.1559 15.3517 8.35998 14.0671 7.37333 numMergedOcc 0
4 mol 162 unq 1 iso 0 dist 8.77869 8.25167 6.71523 12.6287 7.76112 14.2948 15.3517 8.35998 14.0671 7.45998 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 9.71223 8.96988 9.653 3.6848 9.82338 8.90571 9.44405 10.568 7.09479 6.61112 numMergedOcc 0
6 mol 218 unq 0 iso 0 dist 6.2441 7.0843 9.92743 3.5359 8.38813 8.75536 7.73315 12.0573 4.72474 7.33709 numMergedOcc 0
7 mol 218 unq 1 iso 0 dist 6.2441 7.0843 9.92743 3.5359 8.38813 8.75536 6.9398 8.31343 6.17651 6.67404 numMergedOcc 0
8 mol 218 unq 2 iso 0 dist 6.2441 7.73315 12.0573 3.5359 8.38813 7.33709 7.0843 9.92743 4.72474 8.75536 numMergedOcc 0
9 mol 218 unq 3 iso 0 dist 6.2441 7.73315 12.0573 3.5359 8.38813 7.33709 6.9398 8.31343 5.61978 6.67404 numMergedOcc 0
10 mol 218 unq 4 iso 0 dist 6.2441 6.9398 8.31343 3.5359 8.38813 6.67404 7.0843 9.92743 6.17651 8.75536 numMergedOcc 0
11 mol 218 unq 5 iso 0 dist 6.2441 6.9398 8.31343 3.5359 8.38813 6.67404 7.73315 12.0573 5.61978 7.33709 numMergedOcc 0
12 mol 219 unq 0 iso 0 dist 9.52151 4.87446 10.9246 7.79138 8.38773 11.734 10.5566 10.0509 13.4387 4.33238 numMergedOcc 0
13 mol 219 unq 1 iso 0 dist 9.52151 4.87446 10.9246 7.79138 8.38773 11.734 9.97512 5.48556 10.7348 7.83604 numMergedOcc 0
14 mol 219 unq 2 iso 0 dist 9.52151 7.49235 13.5876 7.79138 8.38773 10.9627 10.5566 10.0509 10.8119 4.33238 numMergedOcc 0
15 mol 219 unq 3 iso 0 dist 9.52151 7.49235 13.5876 7.79138 8.38773 10.9627 9.97512 5.48556 10.6748 7.83604 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 6.44932 7.08539 5.47633 4.46929 8.31344 11.0129 10.3464 15.2767 16.4493 8.19317 numMergedOcc 0
17 mol 235 unq 1 iso 0 dist 6.44932 7.08539 5.47633 4.46929 8.31344 11.0129 9.4144 11.9322 15.4 5.1823 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 8.28364 6.86162 5.75876 10.4256 7.89993 12.1846 16.5515 12.7467 15.967 8.67156 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 8.92332 5.75596 13.9754 12.7808 6.79765 17.5894 18.4389 9.91235 22.7051 9.74118 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 8.92332 5.75596 13.9754 9.55943 6.13272 13.4489 10.9895 12.9146 10.3106 9.46442 numMergedOcc 0
21 mol 292 unq 2 iso 0 dist 8.92332 5.75596 13.9754 6.65781 7.02679 9.9182 10.9895 12.9146 10.3106 7.30758 numMergedOcc 0
22 mol 292 unq 3 iso 0 dist 8.92332 5.75596 13.9754 6.65781 7.02679 9.9182 8.37867 5.4258 12.1693 9.10788 numMergedOcc 0
23 mol 292 unq 4 iso 0 dist 8.92332 5.75596 13.9754 4.00064 9.08889 8.9221 8.37867 5.4258 12.1693 8.85064 numMergedOcc 0
24 mol 292 unq 5 iso 0 dist 8.92332 9.11438 10.1063 12.7808 6.79765 15.9592 18.4389 9.91235 16.4203 9.74118 numMergedOcc 0
25 mol 292 unq 6 iso 0 dist 8.92332 9.11438 10.1063 9.55943 6.13272 12.3729 10.9895 12.9146 10.5196 9.46442 numMergedOcc 0
26 mol 292 unq 7 iso 0 dist 8.92332 9.11438 10.1063 6.65781 7.02679 10.3441 5.75596 13.9754 10.0122 9.9182 numMergedOcc 0
27 mol 292 unq 8 iso 0 dist 8.92332 9.11438 10.1063 6.65781 7.02679 10.3441 10.9895 12.9146 10.5196 7.30758 numMergedOcc 0
28 mol 292 unq 9 iso 0 dist 8.92332 9.11438 10.1063 6.65781 7.02679 10.3441 8.37867 5.4258 5.51626 9.10788 numMergedOcc 0
29 mol 292 unq 10 iso 0 dist 8.92332 9.11438 10.1063 4.00064 9.08889 11.1255 5.75596 13.9754 10.0122 8.9221 numMergedOcc 0
30 mol 292 unq 11 iso 0 dist 8.92332 9.11438 10.1063 4.00064 9.08889 11.1255 8.37867 5.4258 5.51626 8.85064 numMergedOcc 0
31 mol 292 unq 12 iso 0 dist 8.92332 8.37867 5.4258 12.7808 6.79765 12.0935 18.4389 9.91235 12.8217 9.74118 numMergedOcc 0
32 mol 292 unq 13 iso 0 dist 8.92332 8.37867 5.4258 9.55943 6.13272 9.96037 10.9895 12.9146 12.6861 9.46442 numMergedOcc 0
33 mol 292 unq 14 iso 0 dist 8.92332 8.37867 5.4258 6.65781 7.02679 9.10788 5.75596 13.9754 12.1693 9.9182 numMergedOcc 0
34 mol 292 unq 15 iso 0 dist 8.92332 8.37867 5.4258 6.65781 7.02679 9.10788 10.9895 12.9146 12.6861 7.30758 numMergedOcc 0
35 mol 292 unq 16 iso 0 dist 8.92332 8.37867 5.4258 4.00064 9.08889 8.85064 5.75596 13.9754 12.1693 8.9221 numMergedOcc 0
