0 mol 48 unq 0 iso 0 dist 6.42242 8.26877 13.697 5.43913 10.8889 5.62671 12.0497 16.2743 7.78689 12.509 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.3768 4.8983 4.39723 9.85386 11.1804 11.6321 5.75925 8.34295 4.27766 14.9297 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.13535 4.8983 4.1846 9.85386 14.019 11.6321 5.75925 5.7684 4.27766 14.9297 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 7.99438 6.65972 10.2709 4.2253 6.1647 5.63083 11.5374 16.9526 9.04293 10.8282 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 7.99438 6.65972 10.2709 4.2253 6.1647 5.63083 5.21981 10.8539 4.78333 4.74254 numMergedOcc 0
5 mol 79 unq 2 iso 0 dist 7.99438 4.2253 6.1647 6.65972 10.2709 5.63083 5.21981 10.8539 4.74254 4.78333 numMergedOcc 0
6 mol 79 unq 3 iso 0 dist 6.64915 6.65972 9.87964 4.2253 4.31939 5.63083 11.5374 14.2209 9.04293 10.8282 numMergedOcc 0
7 mol 79 unq 4 iso 0 dist 6.64915 6.65972 9.87964 4.2253 4.31939 5.63083 5.21981 8.50427 4.78333 4.74254 numMergedOcc 0
8 mol 79 unq 5 iso 0 dist 6.64915 4.2253 4.31939 6.65972 9.87964 5.63083 5.21981 8.50427 4.74254 4.78333 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 9.18097 7.51319 5.22259 8.49887 7.66499 2.58673 8.08787 5.05893 4.29937 5.37869 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 9.18097 7.51319 5.22259 8.49887 7.66499 2.58673 10.4844 5.71866 3.65628 4.05415 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 9.18097 7.51319 5.22259 8.49887 7.66499 2.58673 16.4231 11.3323 9.77774 9.97944 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 9.18097 8.49887 7.66499 7.51319 5.22259 2.58673 8.08787 5.05893 5.37869 4.29937 numMergedOcc 0
13 mol 85 unq 4 iso 0 dist 9.18097 8.49887 7.66499 7.51319 5.22259 2.58673 10.4844 5.71866 4.05415 3.65628 numMergedOcc 0
14 mol 85 unq 5 iso 0 dist 9.18097 8.49887 7.66499 7.51319 5.22259 2.58673 16.4231 11.3323 9.97944 9.77774 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 7.13064 8.55758 5.64998 7.44027 4.76749 2.81832 5.84807 9.19977 6.67678 7.24956 numMergedOcc 0
16 mol 93 unq 1 iso 0 dist 7.13064 7.44027 4.76749 8.55758 5.64998 2.81832 5.84807 9.19977 7.24956 6.67678 numMergedOcc 0
17 mol 93 unq 2 iso 0 dist 7.8962 8.55758 4.34681 7.44027 5.73248 2.81832 5.84807 7.28831 6.67678 7.24956 numMergedOcc 0
18 mol 93 unq 3 iso 0 dist 7.8962 7.44027 5.73248 8.55758 4.34681 2.81832 5.84807 7.28831 7.24956 6.67678 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 8.46376 8.12558 10.3222 9.57243 3.84623 13.315 4.62155 7.58337 5.95801 10.3229 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 8.49831 8.09561 5.83776 9.07315 11.2086 6.01609 14.2685 12.8145 8.60651 10.6225 numMergedOcc 0
21 mol 194 unq 0 iso 0 dist 8.09776 7.56217 12.7379 9.81055 15.4151 3.78714 5.39223 9.64441 4.45769 5.89939 numMergedOcc 0
22 mol 194 unq 1 iso 0 dist 8.09776 7.56217 12.7379 9.81055 15.4151 3.78714 7.15294 13.1921 8.99961 8.18853 numMergedOcc 0
23 mol 194 unq 2 iso 0 dist 8.09776 9.81055 15.4151 7.56217 12.7379 3.78714 5.39223 9.64441 5.89939 4.45769 numMergedOcc 0
24 mol 194 unq 3 iso 0 dist 8.09776 9.81055 15.4151 7.56217 12.7379 3.78714 7.15294 13.1921 8.18853 8.99961 numMergedOcc 0
25 mol 194 unq 4 iso 0 dist 5.4455 7.56217 3.7326 9.81055 7.29209 3.78714 5.39223 4.19371 4.45769 5.89939 numMergedOcc 0
26 mol 194 unq 5 iso 0 dist 5.4455 7.56217 3.7326 9.81055 7.29209 3.78714 7.15294 9.71015 8.99961 8.18853 numMergedOcc 0
27 mol 194 unq 6 iso 0 dist 5.4455 9.81055 7.29209 7.56217 3.7326 3.78714 5.39223 4.19371 5.89939 4.45769 numMergedOcc 0
28 mol 194 unq 7 iso 0 dist 5.4455 9.81055 7.29209 7.56217 3.7326 3.78714 7.15294 9.71015 8.18853 8.99961 numMergedOcc 0
29 mol 253 unq 0 iso 0 dist 8.64294 9.80396 5.35601 6.3093 6.06804 6.8233 12.9816 11.206 9.454 14.4242 numMergedOcc 0
30 mol 285 unq 0 iso 0 dist 6.46935 4.95596 9.60745 7.08681 8.21781 11.9982 5.62841 11.1524 4.27826 11.2031 numMergedOcc 0
31 mol 285 unq 1 iso 0 dist 6.46935 4.95596 9.60745 6.3508 12.3762 4.87372 5.62841 11.1524 4.27826 5.82074 numMergedOcc 0
32 mol 285 unq 2 iso 0 dist 6.46935 4.95596 9.60745 8.3005 8.69747 6.95388 5.62841 11.1524 4.27826 11.0752 numMergedOcc 0
33 mol 285 unq 3 iso 0 dist 6.46935 6.3508 12.3762 7.08681 8.21781 11.9803 5.62841 11.1524 5.82074 11.2031 numMergedOcc 0
34 mol 285 unq 4 iso 0 dist 6.46935 6.3508 12.3762 4.95596 9.60745 4.87372 5.62841 11.1524 5.82074 4.27826 numMergedOcc 0
35 mol 285 unq 5 iso 0 dist 6.46935 6.3508 12.3762 8.3005 8.69747 9.46838 5.62841 11.1524 5.82074 11.0752 numMergedOcc 0
