0 mol 20 unq 0 iso 0 dist 7.4268 8.33409 12.1677 9.32581 12.9056 3.8792 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.58408 9.26742 11.8097 9.41386 13.9217 6.21847 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.58408 9.26742 11.8097 4.71964 10.9035 11.8561 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 9.58408 9.26742 11.8097 6.58478 6.68887 11.5288 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 6.55456 9.29599 4.71664 8.31272 9.90229 10.8954 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 7.60665 8.12417 7.34949 9.58578 4.56998 5.14602 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 6.13054 9.4827 4.90131 9.34754 10.7289 15.5557 numMergedOcc 0
7 mol 132 unq 1 iso 0 dist 6.13054 9.0788 13.8244 9.34754 10.7289 7.21958 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 5.70397 9.00763 9.60726 6.3407 5.23547 12.4426 numMergedOcc 0
9 mol 205 unq 1 iso 0 dist 4.67361 9.00763 5.18043 6.3407 9.39472 12.4426 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 5.15585 6.44327 6.30987 6.05978 4.8189 6.76934 numMergedOcc 0
11 mol 220 unq 1 iso 0 dist 5.15585 9.15362 11.661 6.05978 4.8189 8.94806 numMergedOcc 0
12 mol 220 unq 2 iso 0 dist 7.71962 8.95635 6.97108 8.87401 7.55646 4.68319 numMergedOcc 0
13 mol 220 unq 3 iso 0 dist 7.71962 9.09314 10.7366 8.87401 7.55646 4.7404 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 7.91542 9.77345 5.79398 9.06892 11.1169 10.9651 numMergedOcc 0
15 mol 228 unq 0 iso 0 dist 9.87391 9.89425 13.6349 9.10819 5.01264 10.6688 numMergedOcc 0
16 mol 228 unq 1 iso 0 dist 9.72673 9.89425 4.60407 9.10819 12.3157 10.6688 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 8.70264 9.79506 4.78629 4.37501 5.21309 7.24408 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 6.64026 9.5953 8.15205 6.759 4.31952 11.4703 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 6.64026 8.64527 11.1662 6.759 4.31952 13.5148 numMergedOcc 0
20 mol 285 unq 2 iso 0 dist 6.64026 8.72607 12.4236 6.759 4.31952 12.7475 numMergedOcc 0
