0 mol 6 unq 0 iso 0 dist 6.8041 4.82562 6.94663 7.33688 9.5447 9.07564 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.88546 5.68079 5.69755 11.1852 6.23015 10.3229 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.3964 5.65754 9.63925 10.4819 6.61696 13.302 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.3964 5.65754 9.63925 5.61248 5.80953 7.7447 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 6.07294 8.45859 6.00929 6.02913 6.21128 10.3608 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 6.8073 7.49794 13.357 7.55257 6.03404 11.3096 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 6.42242 5.43913 10.8889 7.51675 6.07052 11.3818 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 6.42242 8.26877 13.697 7.51675 6.07052 11.456 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.13535 9.85386 14.019 5.75925 5.7684 14.9297 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.13535 4.8983 4.1846 5.75925 5.7684 4.27766 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.18097 7.51319 5.22259 8.08787 5.05893 4.29937 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 9.18097 7.51319 5.22259 10.4844 5.71866 3.65628 numMergedOcc 0
12 mol 85 unq 2 iso 0 dist 9.18097 8.49887 7.66499 8.08787 5.05893 5.37869 numMergedOcc 0
13 mol 85 unq 3 iso 0 dist 9.18097 8.49887 7.66499 10.4844 5.71866 4.05415 numMergedOcc 0
14 mol 85 unq 4 iso 0 dist 8.83135 9.43839 5.22259 11.053 5.05893 4.29937 numMergedOcc 0
15 mol 85 unq 5 iso 0 dist 8.83135 9.43839 5.22259 7.97629 5.71866 3.65628 numMergedOcc 0
16 mol 91 unq 0 iso 0 dist 6.93893 8.91998 12.8723 5.09341 8.77355 7.71625 numMergedOcc 0
17 mol 93 unq 0 iso 0 dist 7.13064 8.55758 5.64998 5.84807 9.19977 6.67678 numMergedOcc 0
18 mol 93 unq 1 iso 0 dist 7.13064 7.44027 4.76749 5.84807 9.19977 7.24956 numMergedOcc 0
19 mol 93 unq 2 iso 0 dist 7.8962 8.55758 4.34681 5.84807 7.28831 6.67678 numMergedOcc 0
20 mol 93 unq 3 iso 0 dist 7.8962 7.44027 5.73248 5.84807 7.28831 7.24956 numMergedOcc 0
21 mol 141 unq 0 iso 0 dist 8.46376 9.57243 3.84623 4.62155 7.58337 10.3229 numMergedOcc 0
22 mol 141 unq 1 iso 0 dist 8.46376 8.12558 10.3222 4.62155 7.58337 5.95801 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 8.09776 7.56217 12.7379 11.8568 9.00322 12.9621 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 8.09776 9.81055 15.4151 11.8568 9.00322 13.7206 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 5.4455 7.56217 3.7326 5.39223 4.19371 4.45769 numMergedOcc 0
26 mol 194 unq 3 iso 0 dist 5.4455 7.56217 3.7326 7.15294 9.71015 8.99961 numMergedOcc 0
27 mol 194 unq 4 iso 0 dist 5.4455 9.81055 7.29209 5.39223 4.19371 5.89939 numMergedOcc 0
28 mol 194 unq 5 iso 0 dist 5.4455 9.81055 7.29209 7.15294 9.71015 8.18853 numMergedOcc 0
29 mol 194 unq 6 iso 0 dist 6.57575 7.96463 12.8597 14.4463 9.00322 20.7671 numMergedOcc 0
30 mol 204 unq 0 iso 0 dist 8.82861 6.46946 8.56684 5.99091 9.48625 10.9013 numMergedOcc 0
31 mol 244 unq 0 iso 0 dist 9.97458 9.3491 11.7712 8.65358 6.53416 14.4958 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 9.29922 9.98182 18.0446 4.91802 7.17958 11.6824 numMergedOcc 0
33 mol 292 unq 0 iso 0 dist 8.67838 9.29687 4.30125 14.3247 8.6233 9.21469 numMergedOcc 0
