0 mol 1 unq 0 iso 0 dist 6.06669 10.5043 9.42611 13.5153 8.69605 7.60616 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.40835 10.879 7.42071 4.81503 7.65802 6.87154 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 7.3754 4.31151 8.03732 5.91456 9.04549 8.51478 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 7.14979 3.62253 9.66457 5.15367 7.44913 7.22461 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 8.70106 13.5246 7.2533 5.40051 8.078 10.1932 numMergedOcc 0
5 mol 103 unq 1 iso 0 dist 8.70106 13.5246 7.2533 14.0531 6.56481 7.61507 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 5.68879 10.0595 7.94271 5.49967 5.2184 4.64183 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 5.68879 12.3404 9.89093 5.49967 5.2184 7.46309 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 9.30597 7.46962 8.28523 8.54767 8.64054 10.7459 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 7.78004 9.39759 8.78825 8.73734 6.08846 7.02165 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 6.53758 11.0584 8.78825 7.28525 6.08846 7.02165 numMergedOcc 0
11 mol 132 unq 0 iso 0 dist 7.14447 8.9682 9.46097 9.07803 9.39389 4.88005 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 4.46578 7.587 9.31413 10.008 8.76088 13.4109 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 6.45502 5.784 8.36163 13.5755 9.38856 13.3026 numMergedOcc 0
14 mol 158 unq 1 iso 0 dist 8.66056 12.2304 8.36163 12.9207 9.38856 13.3026 numMergedOcc 0
15 mol 174 unq 0 iso 0 dist 9.14165 4.47486 7.22982 9.23787 7.27146 10.6939 numMergedOcc 0
16 mol 174 unq 1 iso 0 dist 9.14165 4.47486 7.22982 4.98201 6.25798 5.05821 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 5.2376 5.4891 8.92113 7.16053 6.80214 10.5985 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 5.2376 5.04898 9.40812 7.16053 6.80214 7.29924 numMergedOcc 0
19 mol 250 unq 0 iso 0 dist 9.73318 8.78646 9.83369 4.11548 8.51703 8.77283 numMergedOcc 0
20 mol 250 unq 1 iso 0 dist 5.75551 5.87668 9.31494 4.11548 5.07895 5.55347 numMergedOcc 0
21 mol 276 unq 0 iso 0 dist 8.0652 8.07628 7.41473 6.40983 7.60807 5.99976 numMergedOcc 0
22 mol 284 unq 0 iso 0 dist 5.62295 7.07777 6.81709 10.8669 7.74965 12.3472 numMergedOcc 0
