0 mol 16 unq 0 iso 0 dist 8.33883 5.45161 6.31718 9.79958 10.8455 7.63133 5.77753 6.2983 5.47769 5.94084 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 7.84983 11.5882 6.62496 12.9335 5.30792 6.86465 16.5678 10.2241 9.58673 5.92889 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 7.84983 11.5882 6.62496 9.56737 4.81926 6.35756 16.5678 10.2241 9.58673 7.05413 numMergedOcc 0
3 mol 58 unq 2 iso 0 dist 9.56737 11.5882 6.35756 12.9335 5.35073 6.86465 16.5678 7.05413 9.58673 5.92889 numMergedOcc 0
4 mol 58 unq 3 iso 0 dist 9.56737 11.5882 6.35756 7.84983 4.81926 6.62496 16.5678 7.05413 9.58673 10.2241 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.68526 8.31041 9.38498 7.26679 15.7123 9.96396 9.51458 13.4082 8.70133 7.41074 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.68526 8.31041 9.38498 9.30776 13.7412 9.75218 9.51458 13.4082 8.70133 15.9882 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.72442 11.7069 9.38498 10.1503 15.7123 9.96396 10.9127 13.4082 8.70133 7.41074 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.72442 11.7069 9.38498 13.2514 13.7412 9.75218 10.9127 13.4082 8.70133 15.9882 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 6.89722 10.4716 9.96396 11.7436 15.7123 9.38498 6.4154 7.41074 8.70133 13.4082 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 6.89722 10.4716 9.96396 14.4206 12.016 9.75218 6.4154 7.41074 8.70133 15.9882 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 7.26679 8.31041 9.96396 9.68526 15.7123 9.38498 9.51458 7.41074 8.70133 13.4082 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 7.26679 8.31041 9.96396 9.30776 12.016 9.75218 9.51458 7.41074 8.70133 15.9882 numMergedOcc 0
13 mol 73 unq 8 iso 0 dist 9.30776 8.31041 9.75218 7.26679 12.016 9.96396 9.51458 15.9882 8.70133 7.41074 numMergedOcc 0
14 mol 73 unq 9 iso 0 dist 9.30776 8.31041 9.75218 9.68526 13.7412 9.38498 9.51458 15.9882 8.70133 13.4082 numMergedOcc 0
15 mol 117 unq 0 iso 0 dist 9.85576 10.4589 7.90328 12.1493 13.1058 9.84395 12.907 4.91401 6.62561 11.3679 numMergedOcc 0
16 mol 127 unq 0 iso 0 dist 8.40046 9.75166 9.30299 12.4824 7.30196 8.14887 8.03243 14.085 8.59981 14.9761 numMergedOcc 0
17 mol 127 unq 1 iso 0 dist 8.40046 9.75166 9.30299 12.4824 7.30196 8.14887 14.4347 13.1312 7.34519 7.41404 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 8.89982 13.2491 8.56324 14.5119 7.65448 6.70283 14.5136 5.99333 9.13561 8.25411 numMergedOcc 0
19 mol 152 unq 1 iso 0 dist 8.89982 13.2491 8.56324 18.3598 10.6875 7.16148 14.5136 5.99333 9.13561 7.89109 numMergedOcc 0
20 mol 156 unq 0 iso 0 dist 9.16591 9.27577 9.83699 13.6067 8.38403 7.44554 8.57453 4.53931 6.27641 7.29758 numMergedOcc 0
21 mol 156 unq 1 iso 0 dist 9.16591 9.27577 9.83699 16.4964 11.2719 8.94056 8.57453 4.53931 6.27641 8.67156 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 8.69888 11.5099 9.0018 14.9263 7.42466 7.652 17.6319 11.0415 9.31887 5.0384 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 8.69888 5.50014 5.6234 14.9263 7.42466 9.92231 12.616 5.28109 9.0664 7.14477 numMergedOcc 0
24 mol 175 unq 2 iso 0 dist 5.08206 12.1783 9.0018 11.7895 7.42466 7.652 14.1664 11.0415 9.31887 5.0384 numMergedOcc 0
25 mol 175 unq 3 iso 0 dist 5.08206 7.28617 5.6234 11.7895 7.42466 9.92231 9.95921 5.28109 9.0664 7.14477 numMergedOcc 0
26 mol 220 unq 0 iso 0 dist 9.8711 4.90657 9.23153 12.6756 10.5449 8.24498 10.4686 6.7067 6.84247 6.05129 numMergedOcc 0
27 mol 220 unq 1 iso 0 dist 9.8711 4.90657 9.23153 12.6756 10.5449 8.24498 10.0817 15.9568 6.99002 11.1321 numMergedOcc 0
28 mol 224 unq 0 iso 0 dist 9.75313 6.46679 6.61986 14.4547 9.54151 9.40098 9.04427 10.7113 8.19953 8.64911 numMergedOcc 0
29 mol 224 unq 1 iso 0 dist 6.08709 7.85135 6.61986 13.1222 9.54151 9.40098 15.1149 10.7113 8.19953 8.64911 numMergedOcc 0
30 mol 224 unq 2 iso 0 dist 6.56437 14.2632 8.95269 9.2491 4.70378 6.57273 14.4755 7.98696 6.87664 7.12232 numMergedOcc 0
31 mol 224 unq 3 iso 0 dist 6.56437 14.2632 8.95269 17.4981 11.5372 5.78342 14.4755 7.98696 6.87664 5.3621 numMergedOcc 0
32 mol 224 unq 4 iso 0 dist 6.23882 15.0038 8.95269 10.6031 4.70378 6.57273 12.5784 7.98696 6.87664 7.12232 numMergedOcc 0
33 mol 224 unq 5 iso 0 dist 6.23882 15.0038 8.95269 17.1183 11.5372 5.78342 12.5784 7.98696 6.87664 5.3621 numMergedOcc 0
34 mol 224 unq 6 iso 0 dist 9.53131 9.59595 8.95269 10.7064 4.70378 6.57273 13.7859 7.98696 6.87664 7.12232 numMergedOcc 0
35 mol 224 unq 7 iso 0 dist 9.53131 9.59595 8.95269 15.1912 11.5372 5.78342 13.7859 7.98696 6.87664 5.3621 numMergedOcc 0
36 mol 224 unq 8 iso 0 dist 9.34636 5.63485 8.95269 9.79616 4.70378 6.57273 8.60781 7.98696 6.87664 7.12232 numMergedOcc 0
37 mol 224 unq 9 iso 0 dist 9.34636 5.63485 8.95269 10.0081 11.5372 5.78342 8.60781 7.98696 6.87664 5.3621 numMergedOcc 0
38 mol 224 unq 10 iso 0 dist 9.33771 4.91322 6.57273 7.39839 5.0744 6.60589 6.4508 5.29877 6.65984 6.12232 numMergedOcc 0
39 mol 224 unq 11 iso 0 dist 7.39839 4.91322 6.60589 9.33771 5.0744 6.57273 6.4508 6.12232 6.65984 5.29877 numMergedOcc 0
40 mol 224 unq 12 iso 0 dist 9.79616 5.63485 6.57273 9.34636 4.70378 8.95269 8.60781 7.12232 6.87664 7.98696 numMergedOcc 0
41 mol 224 unq 13 iso 0 dist 9.79616 5.63485 6.57273 10.0081 8.49799 5.78342 8.60781 7.12232 6.87664 5.3621 numMergedOcc 0
42 mol 224 unq 14 iso 0 dist 9.29703 4.8786 5.78342 12.8171 11.5372 8.95269 11.0076 5.3621 6.87664 7.98696 numMergedOcc 0
43 mol 224 unq 15 iso 0 dist 9.29703 4.8786 5.78342 11.1052 8.49799 6.57273 11.0076 5.3621 6.87664 7.12232 numMergedOcc 0
44 mol 227 unq 0 iso 0 dist 9.17826 14.9329 7.22101 13.0242 4.39704 7.09863 8.34104 6.43754 8.17891 9.13836 numMergedOcc 0
45 mol 227 unq 1 iso 0 dist 9.64299 7.69739 7.09863 12.7101 4.39704 7.22101 14.2244 9.13836 8.17891 6.43754 numMergedOcc 0
46 mol 234 unq 0 iso 0 dist 5.89084 4.74041 6.56247 10.6962 6.29886 8.34494 10.6283 11.216 6.25105 10.3337 numMergedOcc 0
47 mol 234 unq 1 iso 0 dist 5.89084 4.74041 6.56247 8.47009 7.82322 9.36357 10.6283 11.216 6.25105 11.4315 numMergedOcc 0
48 mol 234 unq 2 iso 0 dist 5.89084 6.16697 9.45496 8.47009 7.82322 6.7625 14.0153 15.9563 9.5707 14.4106 numMergedOcc 0
49 mol 234 unq 3 iso 0 dist 5.89084 6.16697 9.45496 8.47009 7.82322 6.7625 10.6283 11.216 7.85175 11.4315 numMergedOcc 0
50 mol 234 unq 4 iso 0 dist 8.47009 4.74041 9.36357 10.6962 12.1694 8.34494 10.6283 11.4315 6.25105 10.3337 numMergedOcc 0
51 mol 234 unq 5 iso 0 dist 8.47009 4.74041 9.36357 5.89084 7.82322 6.56247 10.6283 11.4315 6.25105 11.216 numMergedOcc 0
52 mol 234 unq 6 iso 0 dist 8.47009 6.16697 6.7625 5.89084 7.82322 9.45496 14.0153 14.4106 9.5707 15.9563 numMergedOcc 0
53 mol 234 unq 7 iso 0 dist 8.47009 6.16697 6.7625 5.89084 7.82322 9.45496 10.6283 11.4315 7.85175 11.216 numMergedOcc 0
54 mol 236 unq 0 iso 0 dist 8.77254 10.054 8.35971 16.0921 14.2337 8.03456 13.6012 6.40312 7.17676 11.8759 numMergedOcc 0
55 mol 236 unq 1 iso 0 dist 8.77254 10.054 8.35971 16.0921 14.2337 8.03456 9.96007 6.2568 6.68463 9.07822 numMergedOcc 0
56 mol 236 unq 2 iso 0 dist 8.77254 10.054 8.35971 16.2964 14.7998 6.84306 13.6012 6.40312 7.17676 11.3552 numMergedOcc 0
57 mol 236 unq 3 iso 0 dist 8.77254 10.054 8.35971 16.2964 14.7998 6.84306 9.96007 6.2568 6.68463 11.6837 numMergedOcc 0
58 mol 236 unq 4 iso 0 dist 8.77254 10.054 8.35971 17.6586 10.7497 9.99038 13.6012 6.40312 7.17676 6.04825 numMergedOcc 0
59 mol 236 unq 5 iso 0 dist 8.77254 10.054 8.35971 17.6586 10.7497 9.99038 9.96007 6.2568 6.68463 8.8265 numMergedOcc 0
60 mol 236 unq 6 iso 0 dist 8.77254 10.054 8.35971 13.4564 12.0369 9.78037 13.6012 6.40312 7.17676 12.6468 numMergedOcc 0
61 mol 236 unq 7 iso 0 dist 8.77254 10.054 8.35971 13.4564 12.0369 9.78037 9.96007 6.2568 6.68463 5.80136 numMergedOcc 0
62 mol 252 unq 0 iso 0 dist 9.73021 16.5881 8.33025 9.89226 6.0987 8.1148 13.899 9.37715 7.66365 4.23801 numMergedOcc 0
63 mol 259 unq 0 iso 0 dist 7.93997 14.8465 7.46176 13.8509 6.96053 7.88519 9.27954 5.79468 7.48005 11.6195 numMergedOcc 0
64 mol 259 unq 1 iso 0 dist 7.93997 14.8465 7.46176 14.9816 7.64658 7.84554 9.27954 5.79468 7.48005 11.8736 numMergedOcc 0
65 mol 259 unq 2 iso 0 dist 7.93997 14.8465 7.46176 17.3348 10.5239 9.18903 9.27954 5.79468 7.48005 12.6649 numMergedOcc 0
66 mol 264 unq 0 iso 0 dist 6.75305 10.0289 6.24356 16.8589 10.3202 9.361 9.67417 5.12409 9.0012 9.74238 numMergedOcc 0
67 mol 264 unq 1 iso 0 dist 6.75305 10.0289 6.24356 16.8589 10.3202 9.361 13.3898 9.67998 9.5784 9.85579 numMergedOcc 0
