0 mol 10 unq 0 iso 0 dist 7.47015 6.41686 8.44864 4.58787 7.8329 10.0703 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.74242 6.04457 8.99751 9.32742 9.82851 3.30063 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.74242 4.13259 9.30674 9.32742 9.82851 6.79894 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 9.74242 5.42557 8.25567 9.32742 9.82851 10.8557 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.63526 5.22908 6.94677 8.29085 9.83914 3.60431 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.02731 13.7005 8.2746 4.85685 8.21895 15.8916 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.19645 5.76592 5.59552 7.8377 9.69694 13.0919 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 6.85457 13.8264 7.4518 7.0652 7.83506 14.6061 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 5.7085 12.0115 9.66068 10.3017 7.40338 3.74516 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.3604 9.48268 7.6793 14.4172 6.90583 7.06015 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 9.3604 9.48268 7.6793 4.55176 6.75593 6 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 9.3604 9.48268 7.6793 3.87386 8.83562 8.90391 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 6.28491 3.96561 7.13378 5.64529 5.95148 4.74818 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 7.91633 12.5923 9.80819 5.96797 5.75959 13.1327 numMergedOcc 0
14 mol 148 unq 1 iso 0 dist 8.94451 8.6534 9.86714 5.96797 6.6946 3.68446 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 8.11909 12.2354 9.81665 6.35328 5.4798 13.0356 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 9.21219 8.82454 9.33412 6.35328 6.32391 3.56564 numMergedOcc 0
17 mol 168 unq 0 iso 0 dist 8.80059 9.52243 8.90876 4.18108 6.12453 7.13766 numMergedOcc 0
18 mol 168 unq 1 iso 0 dist 8.80059 9.52243 8.90876 3.6038 9.87447 7.29489 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 9.51913 5.61615 8.7085 8.16982 9.06389 5.00761 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 7.41653 11.4452 8.63176 3.57554 9.36974 10.3385 numMergedOcc 0
