0 mol 63 unq 0 iso 0 dist 7.48334 5.24476 7.44913 4.6483 9.56188 9.57875 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 7.44693 4.93428 7.15248 13.8123 9.8048 12.8718 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 7.44693 9.09433 8.43162 13.8123 9.8048 9.08666 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.70465 6.15303 7.45777 8.54022 6.85356 10.345 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.70465 6.15303 7.45777 15.6804 7.32265 14.1204 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 6.31955 4.04981 7.18976 5.87352 8.03603 9.2094 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 6.45731 12.523 8.64054 7.39545 6.93718 6.95591 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.58727 8.50536 8.8353 7.22293 5.92836 7.82218 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 8.57243 11.0811 9.96635 12.5458 8.95432 17.5374 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 7.74764 6.46011 6.72718 5.80424 9.60838 11.315 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 9.9897 6.33039 9.79293 6.62558 6.82209 8.95238 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 9.30279 14.415 8.05949 4.12996 8.50367 11.5037 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 9.30279 14.415 8.05949 6.5876 8.94889 15.7959 numMergedOcc 0
13 mol 271 unq 0 iso 0 dist 6.56531 10.9694 9.50884 5.22029 5.76281 7.94329 numMergedOcc 0
14 mol 280 unq 0 iso 0 dist 8.45851 7.31678 4.45141 11.5456 6.38295 5.846 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 6.99084 10.4062 7.14859 7.01799 8.5458 14.0575 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 6.99084 10.4062 7.14859 8.22833 8.56533 10.6005 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 6.99084 10.4062 7.14859 7.01799 8.5458 14.0575 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 6.99084 10.4062 7.14859 8.22833 8.56533 10.6005 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 6.99084 10.4062 7.14859 7.01799 8.5458 14.0575 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 6.99084 10.4062 7.14859 8.22833 8.56533 10.6005 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 9.00901 11.231 6.37998 16.7838 8.46311 9.503 numMergedOcc 0
22 mol 294 unq 1 iso 0 dist 9.00901 14.1974 9.77023 16.7838 8.46311 14.1763 numMergedOcc 0
23 mol 294 unq 2 iso 0 dist 8.46132 6.66087 6.37998 5.23252 8.46311 9.503 numMergedOcc 0
24 mol 294 unq 3 iso 0 dist 8.46132 13.8417 9.77023 5.23252 8.46311 14.1763 numMergedOcc 0
