0 mol 28 unq 0 iso 0 dist 9.04621 7.61643 15.7682 7.88348 7.43758 14.7068 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.44081 8.85208 15.7682 8.72422 7.43758 14.7068 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 8.44081 9.04974 9.64016 8.72422 7.43758 14.9831 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.9084 9.77244 9.43583 6.90675 5.68841 14.0875 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 6.9084 9.77244 9.43583 9.54437 7.75769 16.6378 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 7.4348 9.907 10.1932 12.3845 9.79739 13.9005 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 9.93594 9.20746 7.82405 9.33983 8.51507 13.4385 numMergedOcc 0
7 mol 116 unq 1 iso 0 dist 9.93594 9.20746 7.82405 5.16799 8.22285 11.4445 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 6.13054 6.71787 4.88005 6.36089 8.08406 11.5671 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 6.13054 6.71787 4.88005 4.10862 5.73579 8.72039 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 9.3164 8.99568 10.627 7.0408 6.59749 12.9329 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 8.63202 7.38306 9.88447 11.452 9.75562 14.2765 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 6.03801 8.39237 8.24186 6.59916 6.64749 6.36789 numMergedOcc 0
13 mol 192 unq 0 iso 0 dist 9.41747 9.96128 8.02909 7.85772 9.9224 5.21088 numMergedOcc 0
14 mol 192 unq 1 iso 0 dist 9.41747 6.69338 12.357 7.85772 9.9224 8.25609 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 6.07688 4.85533 8.39486 6.9685 9.00921 9.88124 numMergedOcc 0
16 mol 271 unq 0 iso 0 dist 7.88092 8.56431 10.0049 3.76546 8.54162 10.0868 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 8.85233 9.21126 8.16859 4.49811 7.40069 11.5135 numMergedOcc 0
18 mol 292 unq 1 iso 0 dist 7.06322 9.21126 5.82472 10.841 9.2899 14.0047 numMergedOcc 0
