0 mol 8 unq 0 iso 0 dist 6.82379 5.7531 7.12263 11.0223 5.00267 9.515 4.94497 8.77457 7.35217 11.1833 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 6.82379 11.0223 5.00267 5.7531 7.12263 9.515 4.94497 8.77457 11.1833 7.35217 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 6.24978 4.88215 7.12263 6.80407 5.00267 9.515 5.61772 8.77457 7.35217 11.1833 numMergedOcc 0
3 mol 8 unq 1 iso 1 dist 6.24978 6.80407 5.00267 4.88215 7.12263 9.515 5.61772 8.77457 11.1833 7.35217 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 9.66439 6.36434 7.12263 8.44094 5.00267 9.515 10.4848 8.77457 7.35217 11.1833 numMergedOcc 0
5 mol 8 unq 2 iso 1 dist 9.66439 8.44094 5.00267 6.36434 7.12263 9.515 10.4848 8.77457 11.1833 7.35217 numMergedOcc 0
6 mol 8 unq 3 iso 0 dist 7.3915 8.79272 7.12263 6.32152 5.00267 9.515 14.1378 8.77457 7.35217 11.1833 numMergedOcc 0
7 mol 8 unq 3 iso 1 dist 7.3915 6.32152 5.00267 8.79272 7.12263 9.515 14.1378 8.77457 11.1833 7.35217 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 4.93188 9.48345 9.40479 14.4162 9.58012 13.4961 5.11617 4.90592 6.99746 11.8996 numMergedOcc 0
9 mol 24 unq 0 iso 1 dist 4.93188 14.4162 9.58012 9.48345 9.40479 13.4961 5.11617 4.90592 11.8996 6.99746 numMergedOcc 0
10 mol 24 unq 1 iso 0 dist 4.93188 9.48345 9.40479 14.4162 9.58012 13.4961 10.8238 8.16324 7.05541 9.15493 numMergedOcc 0
11 mol 24 unq 1 iso 1 dist 4.93188 14.4162 9.58012 9.48345 9.40479 13.4961 10.8238 8.16324 9.15493 7.05541 numMergedOcc 0
12 mol 24 unq 2 iso 0 dist 9.24958 13.1456 9.40479 10.0655 9.58012 13.4961 13.2229 4.90592 6.99746 11.8996 numMergedOcc 0
13 mol 24 unq 2 iso 1 dist 9.24958 10.0655 9.58012 13.1456 9.40479 13.4961 13.2229 4.90592 11.8996 6.99746 numMergedOcc 0
14 mol 24 unq 3 iso 0 dist 9.24958 13.1456 9.40479 10.0655 9.58012 13.4961 6.7828 8.16324 7.05541 9.15493 numMergedOcc 0
15 mol 24 unq 3 iso 1 dist 9.24958 10.0655 9.58012 13.1456 9.40479 13.4961 6.7828 8.16324 9.15493 7.05541 numMergedOcc 0
16 mol 28 unq 0 iso 0 dist 7.28416 4.74049 9.72965 10.2179 5.63315 12.4034 8.4285 7.40415 12.67 7.00226 numMergedOcc 0
17 mol 28 unq 0 iso 1 dist 7.28416 10.2179 5.63315 4.74049 9.72965 12.4034 8.4285 7.40415 7.00226 12.67 numMergedOcc 0
18 mol 28 unq 1 iso 0 dist 7.28416 4.74049 9.72965 7.01194 9.8465 10.0322 8.4285 7.40415 12.67 5.93722 numMergedOcc 0
19 mol 28 unq 1 iso 1 dist 7.28416 7.01194 9.8465 4.74049 9.72965 10.0322 8.4285 7.40415 5.93722 12.67 numMergedOcc 0
20 mol 28 unq 1 iso 0 dist 7.28416 10.2179 5.63315 7.01194 9.8465 8.71076 8.4285 7.40415 7.00226 5.93722 numMergedOcc 0
21 mol 28 unq 1 iso 1 dist 7.28416 7.01194 9.8465 10.2179 5.63315 8.71076 8.4285 7.40415 5.93722 7.00226 numMergedOcc 0
22 mol 92 unq 0 iso 0 dist 8.86674 6.89636 8.48184 6.09514 9.01011 7.72337 9.66102 7.39179 13.3326 9.01596 numMergedOcc 0
23 mol 92 unq 0 iso 1 dist 8.86674 6.09514 9.01011 6.89636 8.48184 7.72337 9.66102 7.39179 9.01596 13.3326 numMergedOcc 0
24 mol 92 unq 1 iso 0 dist 8.65802 12.1157 8.03028 7.23437 7.39754 7.72337 13.534 8.57827 12.6909 15.1698 numMergedOcc 0
25 mol 92 unq 1 iso 1 dist 8.65802 7.23437 7.39754 12.1157 8.03028 7.72337 13.534 8.57827 15.1698 12.6909 numMergedOcc 0
26 mol 92 unq 2 iso 0 dist 8.65802 12.1157 8.03028 7.23437 7.39754 7.72337 5.83515 7.94453 7.57205 6.82081 numMergedOcc 0
27 mol 92 unq 2 iso 1 dist 8.65802 7.23437 7.39754 12.1157 8.03028 7.72337 5.83515 7.94453 6.82081 7.57205 numMergedOcc 0
28 mol 93 unq 0 iso 0 dist 9.81831 11.6865 5.51624 12.2598 7.8674 12.9364 4.4022 7.62611 11.4196 8.05783 numMergedOcc 0
29 mol 93 unq 0 iso 1 dist 9.81831 12.2598 7.8674 11.6865 5.51624 12.9364 4.4022 7.62611 8.05783 11.4196 numMergedOcc 0
30 mol 93 unq 1 iso 0 dist 9.12858 7.64463 5.51624 14.8533 7.8674 12.9364 8.96224 7.62611 11.4196 8.05783 numMergedOcc 0
31 mol 93 unq 1 iso 1 dist 9.12858 14.8533 7.8674 7.64463 5.51624 12.9364 8.96224 7.62611 8.05783 11.4196 numMergedOcc 0
32 mol 93 unq 2 iso 0 dist 9.4523 8.29171 5.51624 12.7936 7.8674 12.9364 10.3849 7.62611 11.4196 8.05783 numMergedOcc 0
33 mol 93 unq 2 iso 1 dist 9.4523 12.7936 7.8674 8.29171 5.51624 12.9364 10.3849 7.62611 8.05783 11.4196 numMergedOcc 0
34 mol 119 unq 0 iso 0 dist 7.77116 4.91132 8.03035 6.08167 7.6968 8.77578 7.20179 8.8562 6.96805 4.86811 numMergedOcc 0
35 mol 119 unq 0 iso 1 dist 7.77116 6.08167 7.6968 4.91132 8.03035 8.77578 7.20179 8.8562 4.86811 6.96805 numMergedOcc 0
36 mol 119 unq 1 iso 0 dist 7.77116 4.91132 8.03035 6.08167 7.6968 8.77578 9.89358 7.91683 13.3975 8.00229 numMergedOcc 0
37 mol 119 unq 1 iso 1 dist 7.77116 6.08167 7.6968 4.91132 8.03035 8.77578 9.89358 7.91683 8.00229 13.3975 numMergedOcc 0
38 mol 156 unq 0 iso 0 dist 5.38091 6.44255 5.90883 5.82636 8.06913 4.10961 5.81563 7.46845 11.3995 11.6326 numMergedOcc 0
39 mol 156 unq 0 iso 1 dist 5.38091 5.82636 8.06913 6.44255 5.90883 4.10961 5.81563 7.46845 11.6326 11.3995 numMergedOcc 0
40 mol 175 unq 0 iso 0 dist 8.0154 12.3408 7.32419 8.68081 8.31961 5.84099 6.29885 8.05247 11.2348 9.23758 numMergedOcc 0
41 mol 175 unq 0 iso 1 dist 8.0154 8.68081 8.31961 12.3408 7.32419 5.84099 6.29885 8.05247 9.23758 11.2348 numMergedOcc 0
42 mol 175 unq 1 iso 0 dist 8.0154 12.3408 7.32419 8.68081 8.31961 5.84099 7.27408 9.71028 8.94702 4.06277 numMergedOcc 0
43 mol 175 unq 1 iso 1 dist 8.0154 8.68081 8.31961 12.3408 7.32419 5.84099 7.27408 9.71028 4.06277 8.94702 numMergedOcc 0
44 mol 186 unq 0 iso 0 dist 9.56197 9.27818 7.55358 9.55926 7.60991 7.61858 9.74148 7.46987 13.1254 8.74186 numMergedOcc 0
45 mol 186 unq 0 iso 1 dist 9.56197 9.55926 7.60991 9.27818 7.55358 7.61858 9.74148 7.46987 8.74186 13.1254 numMergedOcc 0
46 mol 186 unq 1 iso 0 dist 7.24795 13.0197 7.55358 12.9082 7.60991 7.61858 7.30024 7.46987 13.1254 8.74186 numMergedOcc 0
47 mol 186 unq 1 iso 1 dist 7.24795 12.9082 7.60991 13.0197 7.55358 7.61858 7.30024 7.46987 8.74186 13.1254 numMergedOcc 0
48 mol 186 unq 2 iso 0 dist 8.64409 4.37002 7.55358 4.64235 7.60991 7.61858 11.6919 7.46987 13.1254 8.74186 numMergedOcc 0
49 mol 186 unq 2 iso 1 dist 8.64409 4.64235 7.60991 4.37002 7.55358 7.61858 11.6919 7.46987 8.74186 13.1254 numMergedOcc 0
50 mol 186 unq 3 iso 0 dist 7.60202 9.72941 7.55358 5.39885 7.60991 7.61858 5.3967 7.46987 13.1254 8.74186 numMergedOcc 0
51 mol 186 unq 3 iso 1 dist 7.60202 5.39885 7.60991 9.72941 7.55358 7.61858 5.3967 7.46987 8.74186 13.1254 numMergedOcc 0
52 mol 194 unq 0 iso 0 dist 6.26839 6.66155 5.52678 5.4499 9.81666 7.62717 11.6598 5.68348 8.43261 13.8424 numMergedOcc 0
53 mol 194 unq 0 iso 1 dist 6.26839 5.4499 9.81666 6.66155 5.52678 7.62717 11.6598 5.68348 13.8424 8.43261 numMergedOcc 0
54 mol 194 unq 1 iso 0 dist 8.12346 6.12973 5.52678 11.0239 9.81666 7.62717 12.0887 5.68348 8.43261 13.8424 numMergedOcc 0
55 mol 194 unq 1 iso 1 dist 8.12346 11.0239 9.81666 6.12973 5.52678 7.62717 12.0887 5.68348 13.8424 8.43261 numMergedOcc 0
56 mol 194 unq 2 iso 0 dist 8.83356 13.0333 5.52678 18.6469 9.81666 7.62717 7.11753 5.68348 8.43261 13.8424 numMergedOcc 0
57 mol 194 unq 2 iso 1 dist 8.83356 18.6469 9.81666 13.0333 5.52678 7.62717 7.11753 5.68348 13.8424 8.43261 numMergedOcc 0
58 mol 194 unq 3 iso 0 dist 8.2654 10.1796 5.52678 13.5457 9.81666 7.62717 12.8755 5.68348 8.43261 13.8424 numMergedOcc 0
59 mol 194 unq 3 iso 1 dist 8.2654 13.5457 9.81666 10.1796 5.52678 7.62717 12.8755 5.68348 13.8424 8.43261 numMergedOcc 0
