0 mol 7 unq 0 iso 0 dist 6.8464 9.15183 5.13353 9.85147 5.99972 9.68006 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.15183 6.8464 5.13353 9.85147 9.68006 5.99972 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 5.24341 6.89519 6.28575 10.2986 9.47063 14.4627 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 5.52992 9.79966 6.76487 4.61383 8.83487 14.2696 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.03754 9.21978 11.3575 11.3298 8.95682 18.9164 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.23812 5.36012 12.0013 14.7042 9.24757 19.9091 numMergedOcc 0
6 mol 101 unq 0 iso 0 dist 8.65215 9.65097 6.69637 4.93063 6.98314 7.61685 numMergedOcc 0
7 mol 101 unq 1 iso 0 dist 9.65097 8.65215 6.69637 4.93063 7.61685 6.98314 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 8.02366 8.93118 12.5551 6.49767 7.33273 14.6318 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 8.11407 8.95375 5.63422 11.6019 6.16414 7.75885 numMergedOcc 0
10 mol 206 unq 1 iso 0 dist 8.11407 8.95375 5.63422 9.98867 7.33701 11.4872 numMergedOcc 0
11 mol 206 unq 2 iso 0 dist 8.11407 8.95375 5.63422 9.88398 8.0871 13.2041 numMergedOcc 0
12 mol 206 unq 3 iso 0 dist 8.95375 8.11407 5.63422 11.6019 7.75885 6.16414 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 9.30975 9.14028 5.16662 4.66376 8.80683 6.11704 numMergedOcc 0
14 mol 226 unq 1 iso 0 dist 9.14028 9.30975 5.16662 4.66376 6.11704 8.80683 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 8.6771 9.58767 5.40359 6.12869 7.57812 10.1217 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 8.6771 9.58767 5.40359 9.81372 8.69104 13.492 numMergedOcc 0
17 mol 248 unq 0 iso 0 dist 8.98788 9.27041 10.8143 6.71088 7.16525 13.4825 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.69358 7.57187 4.26007 10.4922 7.6595 10.8994 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 7.57187 7.69358 4.26007 12.7787 9.63959 10.3917 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 5.00128 9.77784 10.1239 6.76449 8.43974 14.8495 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.7743 8.19169 13.1959 9.62532 9.65934 16.8377 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.7743 8.71506 4.8356 9.62532 9.65934 14.0537 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 7.7743 8.19169 13.1959 9.62532 9.65934 16.8377 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 7.7743 8.71506 4.8356 9.62532 9.65934 14.0537 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 7.7743 8.19169 13.1959 9.62532 9.65934 16.8377 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 7.7743 8.71506 4.8356 9.62532 9.65934 14.0537 numMergedOcc 0
