0 mol 37 unq 0 iso 0 dist 7.49156 8.79419 8.37816 5.6206 4.07334 5.48483 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 8.89504 5.14955 4.5673 7.39431 6.87036 3.61653 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.1895 10.8886 8.3768 5.18016 9.85386 11.1804 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.1895 10.8886 8.3768 11.1255 4.8983 4.39723 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 9.1895 12.3224 8.13535 5.18016 9.85386 14.019 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 9.1895 12.3224 8.13535 11.1255 4.8983 4.1846 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 4.65445 9.34909 8.3768 8.99414 9.85386 11.1804 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 4.65445 9.34909 8.3768 7.45035 4.8983 4.39723 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 4.65445 8.80182 8.13535 8.99414 9.85386 14.019 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 4.65445 8.80182 8.13535 7.45035 4.8983 4.1846 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 9.5546 14.3703 8.3768 15.5364 9.85386 11.1804 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 9.5546 14.3703 8.3768 11.0072 4.8983 4.39723 numMergedOcc 0
12 mol 73 unq 10 iso 0 dist 9.5546 14.9297 8.13535 15.5364 9.85386 14.019 numMergedOcc 0
13 mol 73 unq 11 iso 0 dist 9.5546 14.9297 8.13535 11.0072 4.8983 4.1846 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 8.76838 4.9181 4.86767 7.1837 7.4113 3.67473 numMergedOcc 0
15 mol 123 unq 0 iso 0 dist 8.96525 13.5151 9.04549 14.9493 8.40918 5.09879 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 8.23488 9.03048 9.23676 11.6355 8.77524 3.85186 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.49935 9.24731 9.85821 7.89186 8.99104 14.7528 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 9.87163 4.91528 9.29788 8.57316 6.93942 5.68255 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 9.87163 4.91528 9.29788 7.56518 9.05161 5.57952 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 7.18927 4.91528 9.50983 8.57316 9.31626 5.68255 numMergedOcc 0
21 mol 253 unq 3 iso 0 dist 7.18927 4.91528 9.50983 7.56518 9.77366 5.57952 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 9.15342 10.9452 9.57659 10.4344 8.13393 6.18399 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 9.15342 6.9158 7.8424 10.4344 8.13393 3.91587 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 6.71883 8.61964 6.46935 13.2048 7.08681 8.21781 numMergedOcc 0
25 mol 285 unq 1 iso 0 dist 6.71883 8.61964 6.46935 4.0507 4.95596 9.60745 numMergedOcc 0
26 mol 285 unq 2 iso 0 dist 6.71883 8.61964 6.46935 8.91965 6.3508 12.3762 numMergedOcc 0
27 mol 285 unq 3 iso 0 dist 6.71883 8.61964 6.46935 7.14533 8.3005 8.69747 numMergedOcc 0
