0 mol 2 unq 0 iso 0 dist 6.52386 15.1719 9.53758 4.88542 7.93028 15.897 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 6.34563 5.04676 5.31026 3.25279 7.77633 8.14612 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.18109 5.02379 6.17472 9.63309 9.45239 5.26203 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 7.7568 5.49728 5.98359 5.04485 8.98454 4.40037 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 7.75667 7.25819 6.61704 8.8955 8.03914 4.64617 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 8.55031 11.9729 8.16059 8.55766 8.16183 4.22256 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 9.60995 10.0087 8.23618 10.6754 6.54758 13.362 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 6.34078 4.97125 9.35329 3.81058 9.21833 5.35632 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.31624 10.0626 7.23435 12.6651 8.16712 5.77267 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 5.68726 9.08204 7.23435 10.0936 8.16712 5.77267 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 7.46882 6.44802 7.23435 3.45332 8.16712 5.77267 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 9.06225 13.42 7.71596 11.0447 8.5069 4.43742 numMergedOcc 0
12 mol 88 unq 0 iso 0 dist 9.4046 7.17073 6.41105 7.32542 5.9443 5.29991 numMergedOcc 0
13 mol 88 unq 1 iso 0 dist 9.4046 7.17073 6.41105 11.423 9.16708 6.73292 numMergedOcc 0
14 mol 89 unq 0 iso 0 dist 7.24906 10.1588 9.14778 9.35696 8.68698 14.2364 numMergedOcc 0
15 mol 90 unq 0 iso 0 dist 9.28585 10.156 8.6308 5.82228 8.48639 8.53951 numMergedOcc 0
16 mol 108 unq 0 iso 0 dist 6.46069 5.64746 9.24001 6.42713 5.60118 8.96376 numMergedOcc 0
17 mol 112 unq 0 iso 0 dist 6.30128 10.8208 9.17909 4.45743 6.88696 7.13056 numMergedOcc 0
18 mol 112 unq 1 iso 0 dist 6.30128 4.59061 9.37708 4.45743 6.88696 8.58795 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 9.2167 6.32623 9.29439 3.74723 6.39945 5.02595 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 6.95914 3.80626 8.51265 3.97541 4.33805 6.94742 numMergedOcc 0
21 mol 148 unq 0 iso 0 dist 9.53814 6.07309 5.34451 8.87807 8.86384 5.43923 numMergedOcc 0
22 mol 183 unq 0 iso 0 dist 9.92635 15.7519 9.81282 10.4828 8.41645 16.3902 numMergedOcc 0
23 mol 183 unq 1 iso 0 dist 7.85507 15.2905 9.81282 6.77174 8.41645 16.3902 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 9.71223 13.4102 8.09373 3.6848 9.82338 12.1879 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 9.71223 13.4102 8.09373 5.33968 7.99933 9.09562 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 7.252 9.99333 7.72242 3.81315 7.578 10.2336 numMergedOcc 0
27 mol 218 unq 0 iso 0 dist 6.2441 6.7488 5.98076 3.5359 8.38813 6.13691 numMergedOcc 0
28 mol 219 unq 0 iso 0 dist 9.52151 6.28221 7.98941 7.79138 8.38773 11.321 numMergedOcc 0
29 mol 230 unq 0 iso 0 dist 6.61442 6.22182 5.00735 3.70816 7.8356 5.01206 numMergedOcc 0
30 mol 230 unq 1 iso 0 dist 6.61442 12.0815 9.27643 3.70816 7.8356 13.7738 numMergedOcc 0
31 mol 230 unq 2 iso 0 dist 7.10283 5.18766 5.00735 5.25967 7.8356 5.01206 numMergedOcc 0
32 mol 230 unq 3 iso 0 dist 7.10283 9.15352 9.27643 5.25967 7.8356 13.7738 numMergedOcc 0
33 mol 243 unq 0 iso 0 dist 8.89116 3.69457 9.60437 7.64134 7.89993 9.84746 numMergedOcc 0
34 mol 243 unq 1 iso 0 dist 8.28364 9.10714 9.60437 10.4256 7.89993 9.84746 numMergedOcc 0
35 mol 269 unq 0 iso 0 dist 7.97206 12.5683 9.91093 12.7945 7.92043 11.5175 numMergedOcc 0
36 mol 269 unq 1 iso 0 dist 7.1068 10.2496 9.91093 3.70752 7.92043 11.5175 numMergedOcc 0
