0 mol 7 unq 0 iso 0 dist 9.02869 4.47024 9.49158 15.1801 6.26619 14.7529 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.29504 7.26523 6.92682 4.82016 8.64111 6.6345 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.04019 5.2746 6.06732 7.07421 8.07619 8.7979 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 7.44828 5.2746 9.54828 4.77227 5.52908 7.26522 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.43409 6.78356 8.80788 4.85596 6.43837 9.78177 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.45777 8.91206 6.88106 10.7405 8.31425 8.39494 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 7.58027 5.14178 5.81309 12.136 9.84068 14.029 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 4.34694 5.14178 4.66422 12.136 9.40167 14.029 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 6.56481 9.7695 6.09055 8.17578 7.06817 9.06479 numMergedOcc 0
9 mol 105 unq 0 iso 0 dist 6.1083 9.75013 10.7715 4.93601 9.16999 13.5527 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 6.87456 8.07799 7.56937 6.57809 9.68834 10.6414 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 7.2833 5.46768 4.52076 5.44336 9.02695 7.92844 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 6.62514 6.13963 4.07871 4.82283 9.85636 10.3357 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 6.20044 9.42862 4.07871 10.7478 9.85636 10.3357 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 7.65121 8.768 10.8204 4.37243 9.24959 13.1323 numMergedOcc 0
15 mol 240 unq 0 iso 0 dist 7.19218 9.30056 5.48054 6.7559 9.38691 9.28676 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 4.85199 6.40153 5.48835 7.98909 8.50063 12.9016 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 9.13604 6.20912 5.48835 14.4037 8.50063 12.9016 numMergedOcc 0
18 mol 268 unq 0 iso 0 dist 7.87089 8.28346 4.53264 6.15589 6.87426 8.87745 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 5.00258 6.91282 5.63803 8.67143 8.99154 13.8904 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 8.22117 5.51953 5.63803 14.573 8.99154 13.8904 numMergedOcc 0
