0 mol 61 unq 0 iso 0 dist 5.74014 8.22841 4.129 9.43734 8.51839 11.4147 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 9.09269 6.69386 13.5448 7.49995 7.49792 10.8695 numMergedOcc 0
2 mol 74 unq 0 iso 0 dist 7.71862 9.73082 6.28556 3.80878 8.4902 8.30395 numMergedOcc 0
3 mol 74 unq 1 iso 0 dist 9.73082 7.71862 6.28556 3.80878 8.30395 8.4902 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 7.40015 6.65816 7.60691 12.2734 7.22615 14.7172 numMergedOcc 0
5 mol 96 unq 1 iso 0 dist 7.40015 6.80014 10.3248 12.2734 7.22615 14.2416 numMergedOcc 0
6 mol 96 unq 2 iso 0 dist 6.65816 7.40015 7.60691 4.51328 8.95766 11.0985 numMergedOcc 0
7 mol 96 unq 3 iso 0 dist 6.65816 7.40015 7.60691 4.89165 8.6548 11.8531 numMergedOcc 0
8 mol 96 unq 4 iso 0 dist 6.65816 6.80014 9.23344 4.51328 8.95766 10.3057 numMergedOcc 0
9 mol 96 unq 5 iso 0 dist 6.65816 6.80014 9.23344 4.89165 8.6548 6.02608 numMergedOcc 0
10 mol 96 unq 6 iso 0 dist 6.80014 7.40015 10.3248 4.89165 6.02608 11.8531 numMergedOcc 0
11 mol 96 unq 7 iso 0 dist 6.80014 6.65816 9.23344 4.89165 6.02608 8.6548 numMergedOcc 0
12 mol 110 unq 0 iso 0 dist 5.33139 8.74224 4.50939 3.32173 7.59747 10.725 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 7.65424 6.71654 7.00937 6.0008 5.86693 10.0082 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 9.56967 7.66242 7.0657 5.37694 9.40603 11.2481 numMergedOcc 0
15 mol 176 unq 1 iso 0 dist 7.66242 9.56967 7.0657 4.99447 8.00223 9.7293 numMergedOcc 0
16 mol 176 unq 2 iso 0 dist 7.66242 9.56967 7.0657 5.46526 9.60695 13.4346 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 5.76109 6.8557 6.46748 8.06206 9.38235 14.1972 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 5.76109 6.8557 6.46748 8.81255 8.95509 12.046 numMergedOcc 0
19 mol 257 unq 0 iso 0 dist 5.50393 8.548 6.57657 14.053 9.79593 15.3665 numMergedOcc 0
20 mol 257 unq 1 iso 0 dist 5.50393 6.61807 4.45719 14.053 9.79593 12.8531 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 7.41633 5.52837 4.24841 3.39008 5.2862 5.31097 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 7.41633 6.73163 9.04521 3.39008 5.2862 8.82611 numMergedOcc 0
23 mol 284 unq 2 iso 0 dist 5.52837 7.41633 4.24841 3.39008 5.31097 5.2862 numMergedOcc 0
24 mol 284 unq 3 iso 0 dist 5.52837 6.73163 5.25829 3.39008 5.31097 8.82611 numMergedOcc 0
