0 mol 7 unq 0 iso 0 dist 9.67498 10.2939 8.85869 15.0231 9.85726 14.1047 13.5103 5.38328 7.5298 10.8678 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.67498 10.2939 8.85869 15.0231 9.85726 14.1047 15.5636 9.19359 7.87568 10.0826 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.32945 15.279 8.85869 17.302 9.85726 14.1047 9.90117 5.38328 7.5298 10.8678 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.32945 15.279 8.85869 17.302 9.85726 14.1047 14.766 9.19359 7.87568 10.0826 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.90117 15.279 7.5298 6.96396 7.21217 14.06 9.32945 5.38328 8.85869 10.2729 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 9.90117 15.279 7.5298 6.96396 7.21217 14.06 14.766 5.02731 7.87568 10.557 numMergedOcc 0
6 mol 55 unq 0 iso 0 dist 7.58788 6.63489 5.62629 11.7622 9.70148 5.33255 10.8396 5.20168 8.34632 11.2187 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.39171 6.13631 7.84699 10.5627 6.89722 13.4367 9.27355 5.47475 8.40844 7.26679 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 5.39171 6.13631 7.84699 10.5627 6.89722 13.4367 8.60363 5.05066 6.99156 10.1503 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 5.39171 12.6081 7.53504 10.5627 6.89722 9.64124 9.27355 5.47475 8.66342 7.26679 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 5.39171 12.6081 7.53504 10.5627 6.89722 9.64124 8.60363 5.05066 7.21285 10.1503 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 5.39171 12.6081 7.53504 10.5627 6.89722 9.64124 12.4571 9.51715 6.95094 14.918 numMergedOcc 0
12 mol 73 unq 5 iso 0 dist 9.27355 6.13631 8.40844 10.8067 9.68526 5.33851 5.39171 5.47475 7.84699 11.7436 numMergedOcc 0
13 mol 73 unq 6 iso 0 dist 9.27355 6.13631 8.40844 10.8067 9.68526 5.33851 8.60363 4.4628 6.99156 9.72442 numMergedOcc 0
14 mol 73 unq 7 iso 0 dist 9.27355 6.13631 8.40844 10.5627 7.26679 13.4367 5.39171 5.47475 7.84699 6.89722 numMergedOcc 0
15 mol 73 unq 8 iso 0 dist 9.27355 6.13631 8.40844 10.5627 7.26679 13.4367 8.60363 4.4628 6.99156 10.1503 numMergedOcc 0
16 mol 73 unq 9 iso 0 dist 9.27355 6.13631 8.40844 17.4113 9.30776 15.7164 5.39171 5.47475 7.84699 14.4206 numMergedOcc 0
17 mol 73 unq 10 iso 0 dist 9.27355 6.13631 8.40844 17.4113 9.30776 15.7164 8.60363 4.4628 6.99156 13.2514 numMergedOcc 0
18 mol 73 unq 11 iso 0 dist 9.27355 12.6081 8.66342 10.8067 9.68526 16.8585 5.39171 5.47475 7.53504 11.7436 numMergedOcc 0
19 mol 73 unq 12 iso 0 dist 9.27355 12.6081 8.66342 10.8067 9.68526 16.8585 8.60363 4.4628 7.21285 9.72442 numMergedOcc 0
20 mol 73 unq 13 iso 0 dist 9.27355 12.6081 8.66342 10.8067 9.68526 16.8585 12.4571 11.6754 6.95094 16.0684 numMergedOcc 0
21 mol 73 unq 14 iso 0 dist 9.27355 12.6081 8.66342 10.5627 7.26679 9.64124 5.39171 5.47475 7.53504 6.89722 numMergedOcc 0
22 mol 73 unq 15 iso 0 dist 9.27355 12.6081 8.66342 10.5627 7.26679 9.64124 8.60363 4.4628 7.21285 10.1503 numMergedOcc 0
23 mol 73 unq 16 iso 0 dist 9.27355 12.6081 8.66342 10.5627 7.26679 9.64124 12.4571 11.6754 6.95094 14.918 numMergedOcc 0
24 mol 73 unq 17 iso 0 dist 9.27355 12.6081 8.66342 17.4113 9.30776 16.0481 5.39171 5.47475 7.53504 14.4206 numMergedOcc 0
25 mol 73 unq 18 iso 0 dist 9.27355 12.6081 8.66342 17.4113 9.30776 16.0481 8.60363 4.4628 7.21285 13.2514 numMergedOcc 0
26 mol 73 unq 19 iso 0 dist 9.27355 12.6081 8.66342 17.4113 9.30776 16.0481 12.4571 11.6754 6.95094 20.2103 numMergedOcc 0
27 mol 73 unq 20 iso 0 dist 8.60363 6.13631 6.99156 10.8067 9.72442 5.33851 5.39171 5.05066 7.84699 11.7436 numMergedOcc 0
28 mol 73 unq 21 iso 0 dist 8.60363 6.13631 6.99156 10.8067 9.72442 5.33851 9.27355 4.4628 8.40844 9.68526 numMergedOcc 0
29 mol 73 unq 22 iso 0 dist 8.60363 6.13631 6.99156 16.3515 9.02288 16.0086 5.39171 5.05066 7.84699 11.1478 numMergedOcc 0
30 mol 73 unq 23 iso 0 dist 8.60363 6.13631 6.99156 16.3515 9.02288 16.0086 9.27355 4.4628 8.40844 9.75201 numMergedOcc 0
31 mol 73 unq 24 iso 0 dist 8.60363 12.6081 7.21285 10.8067 9.72442 16.8585 5.39171 5.05066 7.53504 11.7436 numMergedOcc 0
32 mol 73 unq 25 iso 0 dist 8.60363 12.6081 7.21285 10.8067 9.72442 16.8585 9.27355 4.4628 8.66342 9.68526 numMergedOcc 0
33 mol 73 unq 26 iso 0 dist 8.60363 12.6081 7.21285 10.8067 9.72442 16.8585 12.4571 7.64038 6.95094 16.0684 numMergedOcc 0
34 mol 73 unq 27 iso 0 dist 8.60363 12.6081 7.21285 16.3515 9.02288 4.91508 5.39171 5.05066 7.53504 11.1478 numMergedOcc 0
35 mol 73 unq 28 iso 0 dist 8.60363 12.6081 7.21285 16.3515 9.02288 4.91508 9.27355 4.4628 8.66342 9.75201 numMergedOcc 0
36 mol 73 unq 29 iso 0 dist 8.60363 12.6081 7.21285 16.3515 9.02288 4.91508 12.4571 7.64038 6.95094 9.58544 numMergedOcc 0
37 mol 73 unq 30 iso 0 dist 9.27331 11.9439 6.99156 10.163 9.72442 5.33851 14.0106 5.05066 7.84699 11.7436 numMergedOcc 0
38 mol 73 unq 31 iso 0 dist 9.27331 11.9439 6.99156 10.163 9.72442 5.33851 10.0291 4.4628 8.40844 9.68526 numMergedOcc 0
39 mol 73 unq 32 iso 0 dist 9.27331 11.9439 6.99156 12.3394 9.02288 16.0086 14.0106 5.05066 7.84699 11.1478 numMergedOcc 0
40 mol 73 unq 33 iso 0 dist 9.27331 11.9439 6.99156 12.3394 9.02288 16.0086 10.0291 4.4628 8.40844 9.75201 numMergedOcc 0
41 mol 73 unq 34 iso 0 dist 9.27331 14.1204 7.21285 10.163 9.72442 16.8585 14.0106 5.05066 7.53504 11.7436 numMergedOcc 0
42 mol 73 unq 35 iso 0 dist 9.27331 14.1204 7.21285 10.163 9.72442 16.8585 10.0291 4.4628 8.66342 9.68526 numMergedOcc 0
43 mol 73 unq 36 iso 0 dist 9.27331 14.1204 7.21285 10.163 9.72442 16.8585 13.8777 7.64038 6.95094 16.0684 numMergedOcc 0
44 mol 73 unq 37 iso 0 dist 9.27331 14.1204 7.21285 12.3394 9.02288 4.91508 14.0106 5.05066 7.53504 11.1478 numMergedOcc 0
45 mol 73 unq 38 iso 0 dist 9.27331 14.1204 7.21285 12.3394 9.02288 4.91508 10.0291 4.4628 8.66342 9.75201 numMergedOcc 0
46 mol 73 unq 39 iso 0 dist 9.27331 14.1204 7.21285 12.3394 9.02288 4.91508 13.8777 7.64038 6.95094 9.58544 numMergedOcc 0
47 mol 181 unq 0 iso 0 dist 8.78709 11.6119 5.77393 9.49952 6.00053 5.32859 15.5964 8.67658 4.35909 7.44191 numMergedOcc 0
48 mol 205 unq 0 iso 0 dist 9.89311 11.7852 5.94835 14.1114 7.07183 5.30941 7.71155 6.26321 6.76947 11.098 numMergedOcc 0
49 mol 211 unq 0 iso 0 dist 9.8921 16.4954 9.45365 11.3877 8.63308 8.91121 13.6015 9.23863 7.14732 11.6517 numMergedOcc 0
50 mol 211 unq 1 iso 0 dist 9.8921 15.2751 7.15386 11.3877 8.63308 7.03173 20.3523 10.7154 9.63472 16.1785 numMergedOcc 0
51 mol 211 unq 2 iso 0 dist 9.8921 17.5039 7.73993 11.3877 8.63308 11.6621 20.3523 10.7154 5.42004 16.1785 numMergedOcc 0
52 mol 220 unq 0 iso 0 dist 7.57712 6.40358 4.3362 6.19375 7.31105 9.20027 7.20255 5.88344 5.51565 10.2676 numMergedOcc 0
53 mol 224 unq 0 iso 0 dist 7.47122 6.1168 7.46044 15.4433 9.75313 13.1803 12.14 16.6444 9.92947 22.9005 numMergedOcc 0
54 mol 224 unq 1 iso 0 dist 6.6537 9.80029 7.46044 4.55824 9.75313 13.1803 19.6567 16.6444 9.92947 22.9005 numMergedOcc 0
55 mol 224 unq 2 iso 0 dist 7.58998 9.07072 6.36813 6.87755 6.23882 5.25583 11.9987 6.35724 4.99301 6.56437 numMergedOcc 0
56 mol 249 unq 0 iso 0 dist 6.18866 6.59067 5.66519 6.28944 5.78121 6.47697 9.3807 5.2966 6.50067 10.4288 numMergedOcc 0
57 mol 249 unq 1 iso 0 dist 6.18866 6.59067 5.66519 12.5843 7.29898 8.68833 9.3807 5.2966 6.50067 8.91685 numMergedOcc 0
58 mol 249 unq 2 iso 0 dist 9.3807 6.59067 6.50067 12.5843 8.91685 8.68833 6.18866 5.2966 5.66519 7.29898 numMergedOcc 0
59 mol 274 unq 0 iso 0 dist 9.07452 14.9337 8.17922 6.11218 7.80446 10.374 22.2668 16.4367 8.26695 16.9664 numMergedOcc 0
60 mol 274 unq 1 iso 0 dist 9.07452 14.9337 8.17922 6.11218 7.80446 10.374 18.1637 12.757 5.59151 12.4776 numMergedOcc 0
61 mol 274 unq 2 iso 0 dist 9.07452 14.9337 8.17922 11.3921 9.86142 7.60191 22.2668 16.4367 8.26695 12.3343 numMergedOcc 0
62 mol 274 unq 3 iso 0 dist 9.07452 14.9337 8.17922 11.3921 9.86142 7.60191 18.1637 12.757 5.59151 7.79904 numMergedOcc 0
63 mol 274 unq 4 iso 0 dist 7.21004 6.33183 5.68643 6.11218 9.91395 7.48637 10.3381 4.94221 8.99974 14.4561 numMergedOcc 0
64 mol 274 unq 5 iso 0 dist 7.21004 6.33183 5.68643 6.11218 9.91395 7.48637 12.6573 6.01628 8.36043 13.4473 numMergedOcc 0
65 mol 274 unq 6 iso 0 dist 6.12202 13.0534 8.05503 5.7574 7.79904 10.9974 16.6257 11.568 9.30966 17.16 numMergedOcc 0
66 mol 274 unq 7 iso 0 dist 6.12202 13.0534 8.05503 5.7574 7.79904 10.9974 11.8821 6.07831 5.38704 12.3343 numMergedOcc 0
67 mol 274 unq 8 iso 0 dist 6.12202 13.0534 8.05503 7.23876 9.02749 16.897 16.6257 11.568 9.30966 17.0107 numMergedOcc 0
68 mol 274 unq 9 iso 0 dist 6.12202 13.0534 8.05503 7.23876 9.02749 16.897 11.8821 6.07831 5.38704 13.3926 numMergedOcc 0
69 mol 274 unq 10 iso 0 dist 6.12202 9.24343 5.59151 5.7574 7.79904 7.60191 11.8821 6.07831 8.26695 12.3343 numMergedOcc 0
70 mol 274 unq 11 iso 0 dist 6.12202 9.24343 5.59151 5.7574 7.79904 7.60191 12.988 12.757 8.17922 9.86142 numMergedOcc 0
71 mol 274 unq 12 iso 0 dist 6.12202 9.24343 5.59151 7.23876 9.02749 13.8866 11.8821 6.07831 8.26695 13.3926 numMergedOcc 0
72 mol 274 unq 13 iso 0 dist 6.12202 9.24343 5.59151 7.23876 9.02749 13.8866 12.988 12.757 8.17922 18.734 numMergedOcc 0
73 mol 274 unq 14 iso 0 dist 6.44266 6.26074 8.17922 6.98398 7.80446 10.374 12.9405 16.4367 8.26695 16.9664 numMergedOcc 0
74 mol 274 unq 15 iso 0 dist 6.44266 6.26074 8.17922 6.98398 7.80446 10.374 10.6014 12.757 5.59151 12.4776 numMergedOcc 0
75 mol 274 unq 16 iso 0 dist 6.44266 6.26074 8.17922 6.99898 9.86142 7.60191 12.9405 16.4367 8.26695 12.3343 numMergedOcc 0
76 mol 274 unq 17 iso 0 dist 6.44266 6.26074 8.17922 6.99898 9.86142 7.60191 10.6014 12.757 5.59151 7.79904 numMergedOcc 0
77 mol 274 unq 18 iso 0 dist 8.75703 9.34663 5.68643 6.98398 9.91395 7.48637 13.5853 4.94221 8.99974 14.4561 numMergedOcc 0
78 mol 274 unq 19 iso 0 dist 8.75703 9.34663 5.68643 6.98398 9.91395 7.48637 10.0237 6.01628 8.36043 13.4473 numMergedOcc 0
79 mol 277 unq 0 iso 0 dist 6.23539 13.1 9.42812 6.13402 8.57532 10.7202 14.8085 11.4925 8.83777 15.5558 numMergedOcc 0
80 mol 277 unq 1 iso 0 dist 6.23539 13.1 9.42812 6.16829 9.02914 17.0927 14.8085 11.4925 8.83777 19.9278 numMergedOcc 0
81 mol 277 unq 2 iso 0 dist 6.23539 13.1 9.42812 7.44724 6.90434 16.2915 14.8085 11.4925 8.83777 16.3185 numMergedOcc 0
82 mol 280 unq 0 iso 0 dist 7.3304 10.5216 9.9227 7.26698 8.85762 5.80223 12.9293 11.5166 9.047 13.1827 numMergedOcc 0
83 mol 282 unq 0 iso 0 dist 7.93511 8.96033 6.40686 9.67023 5.67266 4.89059 13.5529 6.38894 7.14443 5.80981 numMergedOcc 0
