0 mol 54 unq 0 iso 0 dist 9.04543 7.68155 7.62107 5.40127 7.21223 3.58191 numMergedOcc 0
1 mol 54 unq 0 iso 1 dist 7.62107 7.68155 9.04543 3.58191 7.21223 5.40127 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.41134 7.14954 8.61357 5.96516 8.185 7.53537 numMergedOcc 0
3 mol 59 unq 0 iso 1 dist 8.61357 7.14954 5.41134 7.53537 8.185 5.96516 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.21809 7.55848 5.69055 3.65947 9.38568 9.48385 numMergedOcc 0
5 mol 69 unq 0 iso 1 dist 5.69055 7.55848 7.21809 9.48385 9.38568 3.65947 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.09675 5.04503 9.02753 11.1342 9.85386 10.0544 numMergedOcc 0
7 mol 73 unq 0 iso 1 dist 9.02753 5.04503 8.09675 10.0544 9.85386 11.1342 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.09675 5.04503 9.02753 8.22845 4.8983 6.96897 numMergedOcc 0
9 mol 73 unq 1 iso 1 dist 9.02753 5.04503 8.09675 6.96897 4.8983 8.22845 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 9.22651 5.31804 5.32892 10.0473 9.51771 7.08749 numMergedOcc 0
11 mol 102 unq 0 iso 1 dist 5.32892 5.31804 9.22651 7.08749 9.51771 10.0473 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 9.15795 3.75614 8.72128 6.58331 7.80268 5.46887 numMergedOcc 0
13 mol 183 unq 0 iso 1 dist 8.72128 3.75614 9.15795 5.46887 7.80268 6.58331 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 8.86627 4.45982 9.10569 9.70184 5.03588 8.12818 numMergedOcc 0
15 mol 192 unq 0 iso 1 dist 9.10569 4.45982 8.86627 8.12818 5.03588 9.70184 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 7.47852 5.47602 6.22332 11.337 7.78392 7.99586 numMergedOcc 0
17 mol 225 unq 0 iso 1 dist 6.22332 5.47602 7.47852 7.99586 7.78392 11.337 numMergedOcc 0
18 mol 246 unq 0 iso 0 dist 9.22642 10.2582 7.63397 6.04606 9.03834 8.86898 numMergedOcc 0
19 mol 246 unq 0 iso 1 dist 7.63397 10.2582 9.22642 8.86898 9.03834 6.04606 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 9.46746 7.93277 7.31698 3.78294 9.48672 5.23608 numMergedOcc 0
21 mol 258 unq 0 iso 1 dist 7.31698 7.93277 9.46746 5.23608 9.48672 3.78294 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 9.80002 8.25517 6.73794 14.1095 8.13393 10.5232 numMergedOcc 0
23 mol 273 unq 0 iso 1 dist 6.73794 8.25517 9.80002 10.5232 8.13393 14.1095 numMergedOcc 0
