0 mol 19 unq 0 iso 0 dist 6.41045 4.77352 6.10339 8.64504 4.44441 8.96634 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 9.40333 7.78455 9.18809 13.9507 10.9724 8.32093 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.67557 11.0833 8.81824 20.324 16.2205 9.43843 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 9.67557 11.0833 8.81824 8.00314 8.37717 7.67463 numMergedOcc 0
4 mol 158 unq 0 iso 0 dist 8.9053 4.43662 6.64326 9.04564 6.05019 9.56702 numMergedOcc 0
5 mol 159 unq 0 iso 0 dist 6.25034 6.68959 6.32159 10.7833 8.0487 9.46535 numMergedOcc 0
6 mol 176 unq 0 iso 0 dist 8.02366 12.1591 6.32146 9.40138 5.02061 5.60333 numMergedOcc 0
7 mol 176 unq 1 iso 0 dist 8.02366 12.1591 6.32146 12.3904 6.40668 5.58647 numMergedOcc 0
8 mol 176 unq 2 iso 0 dist 8.02366 12.1591 6.32146 14.0566 10.3398 8.5733 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 9.06702 7.42371 9.07173 11.8604 6.1548 8.58391 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 8.52924 13.6456 7.23959 10.8414 6.49049 8.42716 numMergedOcc 0
11 mol 206 unq 0 iso 0 dist 8.11407 10.6811 9.73419 10.4918 4.46135 9.24832 numMergedOcc 0
12 mol 206 unq 1 iso 0 dist 8.95375 10.6811 6.11803 10.4918 3.56132 9.24832 numMergedOcc 0
13 mol 206 unq 2 iso 0 dist 9.29007 5.24963 6.11803 11.1494 3.56132 9.24832 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 7.69358 12.3956 5.8473 12.0601 5.82277 8.27566 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 6.84604 4.72877 5.77089 11.9878 5.33325 9.68335 numMergedOcc 0
16 mol 282 unq 0 iso 0 dist 9.4493 14.2231 8.76788 19.4975 10.9871 7.89625 numMergedOcc 0
