0 mol 61 unq 0 iso 0 dist 8.22998 8.88571 13.2814 5.33982 8.65313 10.9902 numMergedOcc 0
1 mol 110 unq 0 iso 0 dist 8.24267 9.64651 4.65265 7.12329 5.36955 5.43052 numMergedOcc 0
2 mol 130 unq 0 iso 0 dist 9.27428 9.74014 6.92297 4.06023 9.12256 12.0897 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 6.20262 9.40268 14.2975 7.59533 5.59311 16.9468 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 6.20262 9.40268 14.2975 11.1028 9.22456 20.359 numMergedOcc 0
5 mol 133 unq 2 iso 0 dist 6.20262 9.40268 14.2975 9.61802 5.7232 15.3661 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 6.63114 8.64606 4.93601 10.581 5.70772 5.82034 numMergedOcc 0
7 mol 183 unq 0 iso 0 dist 6.09949 6.5372 5.7856 9.24396 8.58404 11.3395 numMergedOcc 0
8 mol 183 unq 1 iso 0 dist 6.09949 6.5372 5.7856 6.29417 8.1126 9.86506 numMergedOcc 0
9 mol 183 unq 2 iso 0 dist 6.09949 9.84306 13.2035 9.24396 8.58404 9.92635 numMergedOcc 0
10 mol 183 unq 3 iso 0 dist 6.09949 9.84306 13.2035 6.29417 8.1126 7.85507 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 7.35204 7.28604 10.6978 12.3268 7.9801 16.0157 numMergedOcc 0
12 mol 226 unq 1 iso 0 dist 7.35204 7.28604 10.6978 9.69333 6.17825 12.1792 numMergedOcc 0
13 mol 256 unq 0 iso 0 dist 8.78452 8.13647 8.84757 3.61842 9.36652 9.71499 numMergedOcc 0
14 mol 256 unq 1 iso 0 dist 5.49716 8.13647 6.28363 3.61842 7.54613 9.71499 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 7.30045 6.89822 9.29663 14.3784 8.93002 17.8624 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 6.6013 8.73109 13.7732 4.50567 8.09021 10.3071 numMergedOcc 0
17 mol 265 unq 1 iso 0 dist 6.6013 7.43195 6.97261 4.50567 8.09021 11.5231 numMergedOcc 0
18 mol 265 unq 2 iso 0 dist 7.85422 8.73109 10.6329 4.50567 6.98451 10.3071 numMergedOcc 0
19 mol 265 unq 3 iso 0 dist 7.85422 7.43195 12.1799 4.50567 6.98451 11.5231 numMergedOcc 0
20 mol 271 unq 0 iso 0 dist 7.77094 9.37908 15.664 13.1592 8.74168 20.4098 numMergedOcc 0
