0 mol 61 unq 0 iso 0 dist 8.22841 5.97418 9.39417 9.43734 11.4147 7.93498 numMergedOcc 0
1 mol 61 unq 1 iso 0 dist 5.74014 5.97418 5.30715 9.43734 8.51839 7.93498 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 8.94847 5.5851 6.04753 6.61175 7.22615 8.79886 numMergedOcc 0
3 mol 104 unq 0 iso 0 dist 6.12716 8.44593 5.83615 9.01125 9.58427 9.43136 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 8.60512 8.29174 6.76394 6.26235 12.653 9.12935 numMergedOcc 0
5 mol 157 unq 0 iso 0 dist 7.78927 6.66184 6.72897 4.15636 8.97914 8.36016 numMergedOcc 0
6 mol 158 unq 0 iso 0 dist 6.72322 8.66056 10.0941 10.7405 6.51748 9.27714 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 8.54623 5.99974 10.6534 10.4305 16.1705 5.5223 numMergedOcc 0
8 mol 192 unq 1 iso 0 dist 8.54623 5.99974 10.6534 13.2584 17.5302 8.00501 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 6.13127 9.3369 8.75176 5.77393 10.4409 9.26192 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 8.46045 7.19924 8.46479 12.6063 17.298 8.99104 numMergedOcc 0
11 mol 252 unq 0 iso 0 dist 6.4889 9.31855 5.3246 11.2225 10.4988 9.09279 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 7.07268 9.71938 4.80236 11.7799 12.787 9.86952 numMergedOcc 0
13 mol 283 unq 0 iso 0 dist 9.24924 6.89455 9.94666 5.91899 13.3954 5.38739 numMergedOcc 0
14 mol 283 unq 1 iso 0 dist 9.72248 8.07626 9.94666 8.32685 13.3954 5.38739 numMergedOcc 0
15 mol 284 unq 0 iso 0 dist 7.41633 5.62295 12.6047 3.39008 5.2862 8.2236 numMergedOcc 0
16 mol 284 unq 1 iso 0 dist 5.52837 5.62295 10.936 3.39008 5.31097 8.2236 numMergedOcc 0
17 mol 284 unq 2 iso 0 dist 6.73163 5.62295 10.1049 3.39008 8.82611 8.2236 numMergedOcc 0
