0 mol 68 unq 0 iso 0 dist 5.73908 7.51075 13.0823 9.33051 9.49165 12.1447 numMergedOcc 0
1 mol 68 unq 1 iso 0 dist 6.77421 7.51075 5.31976 9.33051 7.81898 12.1447 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 8.39608 7.35142 5.87956 8.67545 5.15022 7.04013 numMergedOcc 0
3 mol 71 unq 1 iso 0 dist 8.39608 7.35142 5.87956 7.23173 11.7226 6.6504 numMergedOcc 0
4 mol 74 unq 0 iso 0 dist 9.09394 9.99155 13.9169 5.23115 10.5428 4.79817 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 5.74637 7.74197 13.1838 8.87924 12.8107 5.31226 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 5.74637 7.86537 12.6939 8.87924 12.8107 9.61103 numMergedOcc 0
7 mol 88 unq 2 iso 0 dist 5.74637 6.35462 6.63027 8.87924 12.8107 7.48682 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 6.36357 4.99966 5.54757 9.7171 5.23889 6.29991 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 4.69402 5.86531 6.25005 7.34386 5.35017 8.6769 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 5.33103 8.62103 11.5481 7.31388 5.06201 9.59996 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 9.01301 8.62103 8.72811 7.31388 6.66834 9.59996 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 8.72285 7.88794 7.38 8.91912 5.49723 5.84474 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 8.20542 5.66569 10.2557 8.38439 7.05684 7.00028 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 9.67311 7.36905 11.6328 8.28871 14.6222 4.48907 numMergedOcc 0
15 mol 264 unq 1 iso 0 dist 9.67311 6.83408 6.28828 8.28871 14.6222 10.1591 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 7.51446 8.12852 9.80419 6.64472 7.65655 6.03386 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 6.28023 9.09967 5.7574 9.91748 5.1571 8.99212 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 6.28023 8.49076 7.23876 9.91748 5.1571 8.33977 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.47179 7.26542 5.10722 9.60904 9.12324 6.7501 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.47179 7.26542 5.10722 9.60904 9.12324 6.7501 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.47179 7.26542 5.10722 9.60904 9.12324 6.7501 numMergedOcc 0
