0 mol 7 unq 0 iso 0 dist 9.67498 10.2939 8.85869 13.5103 5.38328 7.5298 19.4202 10.2729 14.06 7.21217 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.32945 15.279 8.85869 9.90117 5.38328 7.5298 6.96396 10.2729 14.06 7.21217 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.90117 15.279 7.5298 9.32945 5.38328 8.85869 17.302 10.8678 14.1047 9.85726 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 5.39171 6.13631 7.84699 9.27355 5.47475 8.40844 10.8067 11.7436 5.33851 9.68526 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 5.39171 6.13631 7.84699 9.27355 5.47475 8.40844 10.5627 6.89722 13.4367 7.26679 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 5.39171 6.13631 7.84699 9.27355 5.47475 8.40844 17.4113 14.4206 15.7164 9.30776 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 5.39171 6.13631 7.84699 8.60363 5.05066 6.99156 10.8067 11.7436 5.33851 9.72442 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 5.39171 6.13631 7.84699 8.60363 5.05066 6.99156 16.3515 11.1478 16.0086 9.02288 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 5.39171 12.6081 7.53504 9.27355 5.47475 8.66342 10.8067 11.7436 16.8585 9.68526 numMergedOcc 0
9 mol 73 unq 6 iso 0 dist 5.39171 12.6081 7.53504 9.27355 5.47475 8.66342 10.5627 6.89722 9.64124 7.26679 numMergedOcc 0
10 mol 73 unq 7 iso 0 dist 5.39171 12.6081 7.53504 9.27355 5.47475 8.66342 17.4113 14.4206 16.0481 9.30776 numMergedOcc 0
11 mol 73 unq 8 iso 0 dist 5.39171 12.6081 7.53504 8.60363 5.05066 7.21285 10.8067 11.7436 16.8585 9.72442 numMergedOcc 0
12 mol 73 unq 9 iso 0 dist 5.39171 12.6081 7.53504 8.60363 5.05066 7.21285 16.3515 11.1478 4.91508 9.02288 numMergedOcc 0
13 mol 73 unq 10 iso 0 dist 5.39171 12.6081 7.53504 12.4571 9.51715 6.95094 16.3515 11.1478 4.91508 9.58544 numMergedOcc 0
14 mol 73 unq 11 iso 0 dist 9.27355 6.13631 8.40844 5.39171 5.47475 7.84699 10.5627 7.26679 13.4367 6.89722 numMergedOcc 0
15 mol 73 unq 12 iso 0 dist 9.27355 6.13631 8.40844 8.60363 4.4628 6.99156 10.8067 9.68526 5.33851 9.72442 numMergedOcc 0
16 mol 73 unq 13 iso 0 dist 9.27355 6.13631 8.40844 8.60363 4.4628 6.99156 16.3515 9.75201 16.0086 9.02288 numMergedOcc 0
17 mol 73 unq 14 iso 0 dist 9.27355 12.6081 8.66342 5.39171 5.47475 7.53504 10.5627 7.26679 9.64124 6.89722 numMergedOcc 0
18 mol 73 unq 15 iso 0 dist 9.27355 12.6081 8.66342 8.60363 4.4628 7.21285 10.8067 9.68526 16.8585 9.72442 numMergedOcc 0
19 mol 73 unq 16 iso 0 dist 9.27355 12.6081 8.66342 8.60363 4.4628 7.21285 16.3515 9.75201 4.91508 9.02288 numMergedOcc 0
20 mol 73 unq 17 iso 0 dist 9.27355 12.6081 8.66342 12.4571 11.6754 6.95094 16.3515 9.75201 4.91508 9.58544 numMergedOcc 0
21 mol 73 unq 18 iso 0 dist 8.60363 6.13631 6.99156 5.39171 5.05066 7.84699 10.5627 10.1503 13.4367 6.89722 numMergedOcc 0
22 mol 73 unq 19 iso 0 dist 8.60363 6.13631 6.99156 9.27355 4.4628 8.40844 10.8067 9.72442 5.33851 9.68526 numMergedOcc 0
23 mol 73 unq 20 iso 0 dist 8.60363 6.13631 6.99156 9.27355 4.4628 8.40844 10.5627 10.1503 13.4367 7.26679 numMergedOcc 0
24 mol 73 unq 21 iso 0 dist 8.60363 6.13631 6.99156 9.27355 4.4628 8.40844 17.4113 13.2514 15.7164 9.30776 numMergedOcc 0
25 mol 73 unq 22 iso 0 dist 8.60363 12.6081 7.21285 5.39171 5.05066 7.53504 10.5627 10.1503 9.64124 6.89722 numMergedOcc 0
26 mol 73 unq 23 iso 0 dist 8.60363 12.6081 7.21285 9.27355 4.4628 8.66342 10.8067 9.72442 16.8585 9.68526 numMergedOcc 0
27 mol 73 unq 24 iso 0 dist 8.60363 12.6081 7.21285 9.27355 4.4628 8.66342 10.5627 10.1503 9.64124 7.26679 numMergedOcc 0
28 mol 73 unq 25 iso 0 dist 8.60363 12.6081 7.21285 9.27355 4.4628 8.66342 17.4113 13.2514 16.0481 9.30776 numMergedOcc 0
29 mol 73 unq 26 iso 0 dist 8.60363 12.6081 7.21285 12.4571 7.64038 6.95094 16.3515 9.02288 4.91508 9.58544 numMergedOcc 0
30 mol 73 unq 27 iso 0 dist 9.27331 11.9439 6.99156 14.0106 5.05066 7.84699 17.0763 10.1503 13.4367 6.89722 numMergedOcc 0
31 mol 73 unq 28 iso 0 dist 9.27331 11.9439 6.99156 10.0291 4.4628 8.40844 10.163 9.72442 5.33851 9.68526 numMergedOcc 0
32 mol 73 unq 29 iso 0 dist 9.27331 11.9439 6.99156 10.0291 4.4628 8.40844 17.0763 10.1503 13.4367 7.26679 numMergedOcc 0
33 mol 73 unq 30 iso 0 dist 9.27331 11.9439 6.99156 10.0291 4.4628 8.40844 12.3629 13.2514 15.7164 9.30776 numMergedOcc 0
34 mol 73 unq 31 iso 0 dist 9.27331 14.1204 7.21285 14.0106 5.05066 7.53504 17.0763 10.1503 9.64124 6.89722 numMergedOcc 0
35 mol 73 unq 32 iso 0 dist 9.27331 14.1204 7.21285 10.0291 4.4628 8.66342 10.163 9.72442 16.8585 9.68526 numMergedOcc 0
36 mol 73 unq 33 iso 0 dist 9.27331 14.1204 7.21285 10.0291 4.4628 8.66342 17.0763 10.1503 9.64124 7.26679 numMergedOcc 0
37 mol 73 unq 34 iso 0 dist 9.27331 14.1204 7.21285 10.0291 4.4628 8.66342 12.3629 13.2514 16.0481 9.30776 numMergedOcc 0
38 mol 73 unq 35 iso 0 dist 9.27331 14.1204 7.21285 13.8777 7.64038 6.95094 12.3394 9.02288 4.91508 9.58544 numMergedOcc 0
39 mol 181 unq 0 iso 0 dist 8.78709 11.6119 5.77393 15.5964 8.67658 4.35909 9.49952 6.00053 5.32859 7.44191 numMergedOcc 0
40 mol 205 unq 0 iso 0 dist 7.71155 11.7852 6.76947 9.89311 6.26321 5.94835 14.1114 11.098 5.30941 7.07183 numMergedOcc 0
41 mol 220 unq 0 iso 0 dist 7.20255 6.40358 5.51565 7.57712 5.88344 4.3362 6.19375 10.2676 9.20027 7.31105 numMergedOcc 0
42 mol 224 unq 0 iso 0 dist 7.58998 9.07072 6.36813 11.9987 6.35724 4.99301 6.87755 6.23882 5.25583 6.56437 numMergedOcc 0
43 mol 249 unq 0 iso 0 dist 6.18866 6.59067 5.66519 9.3807 5.2966 6.50067 12.5843 7.29898 8.68833 8.91685 numMergedOcc 0
44 mol 249 unq 1 iso 0 dist 9.3807 6.59067 6.50067 6.18866 5.2966 5.66519 6.28944 10.4288 6.47697 5.78121 numMergedOcc 0
45 mol 249 unq 2 iso 0 dist 9.3807 6.59067 6.50067 6.18866 5.2966 5.66519 12.5843 8.91685 8.68833 7.29898 numMergedOcc 0
46 mol 274 unq 0 iso 0 dist 9.07452 14.9337 8.17922 18.1637 12.757 5.59151 11.3921 9.86142 7.60191 7.79904 numMergedOcc 0
47 mol 274 unq 1 iso 0 dist 9.07452 14.9337 8.17922 18.1637 12.757 5.59151 22.7601 18.734 13.8866 9.02749 numMergedOcc 0
48 mol 274 unq 2 iso 0 dist 7.21004 6.33183 5.68643 12.6573 6.01628 8.36043 11.9878 10.5629 8.13367 9.81815 numMergedOcc 0
49 mol 274 unq 3 iso 0 dist 6.12202 9.24343 5.59151 12.988 12.757 8.17922 9.92527 12.4776 10.374 7.80446 numMergedOcc 0
50 mol 274 unq 4 iso 0 dist 6.12202 9.24343 5.59151 12.988 12.757 8.17922 5.7574 7.79904 7.60191 9.86142 numMergedOcc 0
51 mol 274 unq 5 iso 0 dist 6.44266 6.26074 8.17922 10.6014 12.757 5.59151 6.99898 9.86142 7.60191 7.79904 numMergedOcc 0
52 mol 274 unq 6 iso 0 dist 6.44266 6.26074 8.17922 10.6014 12.757 5.59151 18.2819 18.734 13.8866 9.02749 numMergedOcc 0
53 mol 274 unq 7 iso 0 dist 8.75703 9.34663 5.68643 10.0237 6.01628 8.36043 6.20472 10.5629 8.13367 9.81815 numMergedOcc 0
54 mol 280 unq 0 iso 0 dist 6.83927 6.12141 9.047 14.1785 11.5166 9.9227 11.1245 13.1827 5.80223 8.85762 numMergedOcc 0
55 mol 282 unq 0 iso 0 dist 7.93511 8.96033 6.40686 13.5529 6.38894 7.14443 9.67023 5.67266 4.89059 5.80981 numMergedOcc 0
