0 mol 28 unq 0 iso 0 dist 8.74311 9.77719 18.1675 8.72422 16.5069 9.3223 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.10093 8.31272 4.78298 3.70978 5.48669 5.41774 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 6.46565 8.31272 5.26955 3.70978 5.78051 5.41774 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.70783 9.06787 6.33588 12.2544 11.6205 5.40748 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.61052 5.14123 4.80894 5.90023 12.1671 9.01601 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 8.39198 8.59846 4.28638 9.33983 12.675 9.87191 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 8.39198 8.59846 4.28638 5.16799 11.0192 9.21528 numMergedOcc 0
7 mol 116 unq 2 iso 0 dist 6.70803 9.6001 4.28638 13.5296 12.675 9.87191 numMergedOcc 0
8 mol 116 unq 3 iso 0 dist 6.70803 9.6001 4.28638 11.9052 11.0192 9.21528 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.75212 6.31404 6.98797 9.27523 6.4822 5.56446 numMergedOcc 0
10 mol 144 unq 0 iso 0 dist 6.7211 8.85737 6.01619 4.28185 6.21815 7.46026 numMergedOcc 0
11 mol 146 unq 0 iso 0 dist 8.36855 8.82192 8.19476 3.96561 9.5348 6.93154 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 6.01466 7.1329 4.53842 5.42437 9.02212 8.8637 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 5.73488 9.48525 7.03597 13.2026 14.3976 9.49163 numMergedOcc 0
14 mol 225 unq 1 iso 0 dist 5.73488 9.48525 7.03597 10.8267 12.9433 9.99149 numMergedOcc 0
15 mol 225 unq 2 iso 0 dist 5.73488 4.58113 4.57447 5.21233 7.11262 7.25438 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 7.72115 5.29501 7.83075 5.5881 8.73545 7.1229 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 7.72115 5.29501 7.83075 5.60683 8.14581 9.55705 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 6.43615 8.81206 7.83075 11.4518 8.73545 7.1229 numMergedOcc 0
19 mol 233 unq 3 iso 0 dist 6.43615 8.81206 7.83075 3.75722 8.14581 9.55705 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 8.65067 8.76085 7.85199 4.86922 11.601 8.70029 numMergedOcc 0
21 mol 257 unq 1 iso 0 dist 8.97581 8.76085 12.5937 4.86922 12.7951 8.70029 numMergedOcc 0
22 mol 257 unq 2 iso 0 dist 6.81706 8.76085 10.4413 4.86922 11.3587 8.70029 numMergedOcc 0
