0 mol 11 unq 0 iso 0 dist 7.8058 9.65468 4.87411 9.13894 5.17527 6.58714 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 7.8058 9.13662 9.9191 9.13894 5.17527 9.65952 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 7.8058 9.14139 5.06605 9.13894 5.17527 9.22103 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 6.34927 9.65468 9.19942 9.13894 6.72189 6.58714 numMergedOcc 0
4 mol 11 unq 4 iso 0 dist 6.34927 9.13662 5.54126 9.13894 6.72189 9.65952 numMergedOcc 0
5 mol 11 unq 5 iso 0 dist 6.34927 9.14139 4.1995 9.13894 6.72189 9.22103 numMergedOcc 0
6 mol 12 unq 0 iso 0 dist 9.42122 6.91627 10.7786 5.76006 7.24704 7.18195 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 9.4196 8.65313 10.0802 9.97224 9.39076 14.6641 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 7.61513 8.65313 11.6698 9.97224 6.25934 14.6641 numMergedOcc 0
9 mol 63 unq 0 iso 0 dist 9.22609 9.3844 6.6928 7.76044 9.23649 4.26696 numMergedOcc 0
10 mol 64 unq 0 iso 0 dist 9.23164 9.72287 13.0602 8.00221 12.9597 6.64905 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 8.55624 9.79412 4.60555 6.98876 5.36674 9.41527 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 8.55624 8.65822 3.89552 6.98876 5.36674 8.14333 numMergedOcc 0
13 mol 108 unq 0 iso 0 dist 9.81705 8.89997 9.35984 9.89763 4.43985 6.94601 numMergedOcc 0
14 mol 108 unq 1 iso 0 dist 9.81705 8.89997 9.35984 8.49918 13.0702 5.53105 numMergedOcc 0
15 mol 108 unq 2 iso 0 dist 6.32309 8.89997 11.9597 9.89763 9.15007 6.94601 numMergedOcc 0
16 mol 108 unq 3 iso 0 dist 6.32309 8.89997 11.9597 8.49918 13.816 5.53105 numMergedOcc 0
17 mol 108 unq 4 iso 0 dist 8.60437 8.89997 13.7036 9.89763 9.33094 6.94601 numMergedOcc 0
18 mol 108 unq 5 iso 0 dist 8.60437 8.89997 13.7036 8.49918 16.0071 5.53105 numMergedOcc 0
19 mol 108 unq 6 iso 0 dist 5.8711 8.69068 4.85222 8.84888 9.65124 14.2308 numMergedOcc 0
20 mol 120 unq 0 iso 0 dist 9.61273 9.31927 8.50035 9.76171 4.30029 12.0548 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 5.52744 7.45384 8.66215 9.4588 12.1562 12.4341 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 6.28379 6.01193 6.63414 9.99681 12.6434 6.04517 numMergedOcc 0
23 mol 233 unq 1 iso 0 dist 9.29279 6.01193 6.16699 9.99681 10.3831 6.04517 numMergedOcc 0
24 mol 233 unq 2 iso 0 dist 8.91643 7.40749 6.63414 9.89626 12.6434 6.04517 numMergedOcc 0
25 mol 233 unq 3 iso 0 dist 8.79848 7.40749 6.16699 9.89626 10.3831 6.04517 numMergedOcc 0
26 mol 247 unq 0 iso 0 dist 6.52457 8.28575 7.07563 8.81684 6.67746 8.96314 numMergedOcc 0
27 mol 256 unq 0 iso 0 dist 8.83662 9.36652 12.5096 6.07677 5.31424 8.22925 numMergedOcc 0
