0 mol 26 unq 0 iso 0 dist 8.84763 7.85533 7.89222 12.0792 5.63833 6.98837 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.74242 12.5403 9.53735 11.6115 10.4631 6.25761 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.74242 12.5403 9.53735 14.0585 4.77336 9.02604 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.63526 5.12242 5.39827 8.10642 12.2523 8.06956 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.95848 7.90724 5.44722 13.1695 6.12351 5.86234 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 9.15189 5.4222 5.44722 11.2591 6.12351 5.86234 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.9724 12.7667 8.14607 16.4116 10.8667 8.60633 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 6.52387 4.64534 5.58337 10.7545 5.45603 7.33408 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 6.52387 4.64534 5.58337 10.9426 9.71548 7.92149 numMergedOcc 0
9 mol 74 unq 0 iso 0 dist 5.20804 9.22247 7.14572 12.7155 7.8245 7.47107 numMergedOcc 0
10 mol 74 unq 1 iso 0 dist 9.63665 5.86631 7.14572 10.4425 7.8245 7.47107 numMergedOcc 0
11 mol 75 unq 0 iso 0 dist 8.73268 5.36918 8.52499 6.8025 5.04643 9.37955 numMergedOcc 0
12 mol 75 unq 1 iso 0 dist 8.73268 7.84419 6.2449 6.8025 5.04643 9.16165 numMergedOcc 0
13 mol 103 unq 0 iso 0 dist 6.37224 5.75619 6.87901 11.5972 7.68855 9.88046 numMergedOcc 0
14 mol 120 unq 0 iso 0 dist 9.52973 4.18642 7.41599 9.31541 4.36082 8.57865 numMergedOcc 0
15 mol 120 unq 1 iso 0 dist 9.52973 4.18642 7.41599 11.138 12.2353 9.52648 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 9.73325 18.9898 9.96946 24.9634 15.9654 6.10045 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 9.97204 8.90596 6.74767 14.1147 4.63072 8.01717 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 9.86987 12.9792 8.16917 12.2817 13.0786 9.39756 numMergedOcc 0
19 mol 272 unq 1 iso 0 dist 9.88921 17.9408 8.16917 21.8608 13.0786 9.39756 numMergedOcc 0
