0 mol 26 unq 0 iso 0 dist 9.32113 9.65198 9.72597 7.23962 8.42581 9.51421 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 6.50983 7.09077 8.62842 5.70213 8.19733 12.6438 numMergedOcc 0
2 mol 39 unq 1 iso 0 dist 6.50983 7.09077 8.62842 11.2297 8.57165 7.19373 numMergedOcc 0
3 mol 39 unq 2 iso 0 dist 6.50983 11.4396 8.27298 5.70213 8.19733 15.6407 numMergedOcc 0
4 mol 39 unq 3 iso 0 dist 6.50983 11.4396 8.27298 11.2297 8.57165 5.14632 numMergedOcc 0
5 mol 39 unq 4 iso 0 dist 6.50983 13.8958 8.56111 5.70213 8.19733 16.7059 numMergedOcc 0
6 mol 39 unq 5 iso 0 dist 6.50983 13.8958 8.56111 11.2297 8.57165 5.90834 numMergedOcc 0
7 mol 52 unq 0 iso 0 dist 8.96804 5.20613 8.76527 8.48826 8.65019 12.4805 numMergedOcc 0
8 mol 52 unq 1 iso 0 dist 7.23669 9.16378 8.76527 6.11606 8.65019 12.4805 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 6.59067 6.25329 9.01516 10.8447 8.98797 16.3372 numMergedOcc 0
10 mol 56 unq 1 iso 0 dist 6.59067 10.4079 7.31255 10.8447 8.98797 7.1144 numMergedOcc 0
11 mol 61 unq 0 iso 0 dist 9.32999 8.71449 9.03044 5.53349 9.66368 4.77152 numMergedOcc 0
12 mol 68 unq 0 iso 0 dist 7.65992 9.34715 9.48391 12.7743 8.80104 10.3036 numMergedOcc 0
13 mol 71 unq 0 iso 0 dist 9.40222 6.46454 9.0907 6.01992 6.48531 4.77689 numMergedOcc 0
14 mol 71 unq 1 iso 0 dist 8.87417 12.7619 9.0907 8.73829 6.48531 4.77689 numMergedOcc 0
15 mol 74 unq 0 iso 0 dist 9.9321 6.76324 9.60205 5.67386 4.79413 6.32526 numMergedOcc 0
16 mol 94 unq 0 iso 0 dist 7.69406 9.93916 9.57635 12.5853 9.13207 10.0163 numMergedOcc 0
17 mol 111 unq 0 iso 0 dist 8.52122 7.6505 4.86701 8.37101 7.92876 9.57451 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 8.63783 13.3496 9.40992 7.00982 6.87906 6.71274 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 8.63783 13.3496 9.40992 9.50607 8.49473 10.5172 numMergedOcc 0
20 mol 156 unq 2 iso 0 dist 8.63783 13.3496 9.40992 7.69314 7.94975 11.7545 numMergedOcc 0
21 mol 156 unq 3 iso 0 dist 8.63783 13.3496 9.40992 16.0317 9.39865 8.15753 numMergedOcc 0
22 mol 156 unq 4 iso 0 dist 8.63783 6.05462 7.44879 7.00982 6.87906 7.81605 numMergedOcc 0
23 mol 156 unq 5 iso 0 dist 8.63783 6.05462 7.44879 9.50607 8.49473 5.70108 numMergedOcc 0
24 mol 156 unq 6 iso 0 dist 8.63783 6.05462 7.44879 7.69314 7.94975 11.6326 numMergedOcc 0
25 mol 156 unq 7 iso 0 dist 8.63783 6.05462 7.44879 16.0317 9.39865 16.5468 numMergedOcc 0
26 mol 156 unq 8 iso 0 dist 7.96867 6.05462 7.64275 7.00982 9.54367 7.81605 numMergedOcc 0
27 mol 156 unq 9 iso 0 dist 7.96867 6.05462 7.64275 7.69314 7.26859 11.6326 numMergedOcc 0
28 mol 163 unq 0 iso 0 dist 7.64106 13.459 8.67619 10.9684 8.21476 5.51913 numMergedOcc 0
29 mol 163 unq 1 iso 0 dist 7.64106 13.459 8.67619 8.9019 7.66897 11.5521 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 6.52129 15.5232 9.62121 12.4402 7.61203 5.30958 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 6.52129 15.5232 9.62121 12.4266 9.47845 7.68455 numMergedOcc 0
32 mol 238 unq 2 iso 0 dist 6.52129 15.5232 9.62121 11.091 6.92409 6.2139 numMergedOcc 0
33 mol 238 unq 3 iso 0 dist 6.52129 15.5232 9.62121 10.4365 6.89694 12.3809 numMergedOcc 0
34 mol 258 unq 0 iso 0 dist 9.84755 15.3111 8.35023 9.58208 9.51311 17.6675 numMergedOcc 0
