0 mol 7 unq 0 iso 0 dist 9.32945 6.22805 4.57188 15.279 8.85869 12.3221 9.90117 5.38328 6.09254 7.5298 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.32945 6.22805 4.57188 15.279 8.85869 12.3221 14.766 9.19359 10.4333 7.87568 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.90117 6.22805 6.09254 15.279 7.5298 12.3221 9.32945 5.38328 4.57188 8.85869 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.90117 6.22805 6.09254 15.279 7.5298 12.3221 14.766 5.02731 10.4333 7.87568 numMergedOcc 0
4 mol 12 unq 0 iso 0 dist 8.98466 8.17618 6.89226 8.5421 7.96154 12.8973 14.8497 7.10076 13.6402 9.64703 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 9.27355 5.47475 9.76331 8.40844 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 8.60363 5.05066 10.4402 6.99156 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 5.39171 4.24428 8.04817 12.6081 7.53504 15.5212 9.27355 5.47475 9.76331 8.66342 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 5.39171 4.24428 8.04817 12.6081 7.53504 15.5212 8.60363 5.05066 10.4402 7.21285 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 5.39171 4.24428 8.04817 12.6081 7.53504 15.5212 12.4571 9.51715 15.8919 6.95094 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 9.27355 5.47475 5.44275 8.40844 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 8.60363 5.05066 8.0624 6.99156 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 5.39171 6.30194 5.2774 12.6081 7.53504 11.801 9.27355 5.47475 5.44275 8.66342 numMergedOcc 0
13 mol 73 unq 8 iso 0 dist 5.39171 6.30194 5.2774 12.6081 7.53504 11.801 8.60363 5.05066 8.0624 7.21285 numMergedOcc 0
14 mol 73 unq 9 iso 0 dist 5.39171 6.30194 5.2774 12.6081 7.53504 11.801 12.4571 9.51715 14.4844 6.95094 numMergedOcc 0
15 mol 73 unq 10 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 5.39171 5.47475 8.04817 7.84699 numMergedOcc 0
16 mol 73 unq 11 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 8.60363 4.4628 10.4402 6.99156 numMergedOcc 0
17 mol 73 unq 12 iso 0 dist 9.27355 4.24428 9.76331 12.6081 8.66342 15.5212 5.39171 5.47475 8.04817 7.53504 numMergedOcc 0
18 mol 73 unq 13 iso 0 dist 9.27355 4.24428 9.76331 12.6081 8.66342 15.5212 8.60363 4.4628 10.4402 7.21285 numMergedOcc 0
19 mol 73 unq 14 iso 0 dist 9.27355 4.24428 9.76331 12.6081 8.66342 15.5212 12.4571 11.6754 15.8919 6.95094 numMergedOcc 0
20 mol 73 unq 15 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 5.39171 5.47475 5.2774 7.84699 numMergedOcc 0
21 mol 73 unq 16 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 8.60363 4.4628 8.0624 6.99156 numMergedOcc 0
22 mol 73 unq 17 iso 0 dist 9.27355 6.30194 5.44275 12.6081 8.66342 11.801 5.39171 5.47475 5.2774 7.53504 numMergedOcc 0
23 mol 73 unq 18 iso 0 dist 9.27355 6.30194 5.44275 12.6081 8.66342 11.801 8.60363 4.4628 8.0624 7.21285 numMergedOcc 0
24 mol 73 unq 19 iso 0 dist 9.27355 6.30194 5.44275 12.6081 8.66342 11.801 12.4571 11.6754 14.4844 6.95094 numMergedOcc 0
25 mol 73 unq 20 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 5.39171 5.05066 8.04817 7.84699 numMergedOcc 0
26 mol 73 unq 21 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 9.27355 4.4628 9.76331 8.40844 numMergedOcc 0
27 mol 73 unq 22 iso 0 dist 8.60363 4.24428 10.4402 12.6081 7.21285 15.5212 5.39171 5.05066 8.04817 7.53504 numMergedOcc 0
28 mol 73 unq 23 iso 0 dist 8.60363 4.24428 10.4402 12.6081 7.21285 15.5212 9.27355 4.4628 9.76331 8.66342 numMergedOcc 0
29 mol 73 unq 24 iso 0 dist 8.60363 4.24428 10.4402 12.6081 7.21285 15.5212 12.4571 7.64038 15.8919 6.95094 numMergedOcc 0
30 mol 73 unq 25 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 5.39171 5.05066 5.2774 7.84699 numMergedOcc 0
31 mol 73 unq 26 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 9.27355 4.4628 5.44275 8.40844 numMergedOcc 0
32 mol 73 unq 27 iso 0 dist 8.60363 6.30194 8.0624 12.6081 7.21285 11.801 5.39171 5.05066 5.2774 7.53504 numMergedOcc 0
33 mol 73 unq 28 iso 0 dist 8.60363 6.30194 8.0624 12.6081 7.21285 11.801 9.27355 4.4628 5.44275 8.66342 numMergedOcc 0
34 mol 73 unq 29 iso 0 dist 8.60363 6.30194 8.0624 12.6081 7.21285 11.801 12.4571 7.64038 14.4844 6.95094 numMergedOcc 0
35 mol 152 unq 0 iso 0 dist 7.53834 6.98781 7.24951 10.7416 7.21636 11.6015 12.1625 5.72609 12.9372 7.99446 numMergedOcc 0
36 mol 173 unq 0 iso 0 dist 5.97008 8.84671 8.75092 8.90271 7.13369 14.9854 14.5609 13.1862 17.8109 9.17063 numMergedOcc 0
37 mol 173 unq 1 iso 0 dist 5.97008 8.84671 8.75092 8.90271 7.13369 14.9854 13.2446 11.2682 14.3171 9.99332 numMergedOcc 0
38 mol 223 unq 0 iso 0 dist 9.29204 9.94212 18.385 4.68566 9.86372 13.4805 9.14789 4.44825 19.0281 7.70946 numMergedOcc 0
39 mol 223 unq 1 iso 0 dist 9.29204 7.34316 8.16187 4.68566 9.86372 11.0403 9.14789 4.44825 11.2364 7.70946 numMergedOcc 0
40 mol 223 unq 2 iso 0 dist 9.14789 9.94212 19.0281 4.68566 7.70946 13.4805 9.29204 4.44825 18.385 9.86372 numMergedOcc 0
41 mol 223 unq 3 iso 0 dist 9.14789 7.34316 11.2364 4.68566 7.70946 11.0403 9.29204 4.44825 8.16187 9.86372 numMergedOcc 0
42 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 9.80029 7.46044 10.6043 19.6567 16.6444 19.7343 9.92947 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 14.9337 8.17922 13.261 22.2668 16.4367 20.9668 8.26695 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 9.07452 6.21831 6.57235 14.9337 8.17922 13.261 18.1637 12.757 17.9772 5.59151 numMergedOcc 0
45 mol 274 unq 2 iso 0 dist 7.21004 6.21831 4.97216 6.33183 5.68643 8.78883 10.3381 4.94221 8.19222 8.99974 numMergedOcc 0
46 mol 274 unq 3 iso 0 dist 7.21004 6.21831 4.97216 6.33183 5.68643 8.78883 12.6573 6.01628 10.2686 8.36043 numMergedOcc 0
47 mol 274 unq 4 iso 0 dist 6.12202 9.81087 7.96313 13.0534 8.05503 12.0756 16.6257 11.568 18.0822 9.30966 numMergedOcc 0
48 mol 274 unq 5 iso 0 dist 6.12202 9.81087 7.96313 13.0534 8.05503 12.0756 11.8821 6.07831 12.0757 5.38704 numMergedOcc 0
49 mol 274 unq 6 iso 0 dist 6.12202 9.81087 7.96313 9.24343 5.59151 5.82876 11.8821 6.07831 12.0757 8.26695 numMergedOcc 0
50 mol 274 unq 7 iso 0 dist 6.12202 9.81087 7.96313 9.24343 5.59151 5.82876 12.988 12.757 7.97998 8.17922 numMergedOcc 0
51 mol 274 unq 8 iso 0 dist 6.44266 9.79674 9.61244 6.26074 8.17922 12.336 12.9405 16.4367 18.4795 8.26695 numMergedOcc 0
52 mol 274 unq 9 iso 0 dist 6.44266 9.79674 9.61244 6.26074 8.17922 12.336 10.6014 12.757 17.8971 5.59151 numMergedOcc 0
53 mol 274 unq 10 iso 0 dist 6.44266 8.3291 6.57235 6.26074 8.17922 13.261 12.9405 16.4367 20.9668 8.26695 numMergedOcc 0
54 mol 274 unq 11 iso 0 dist 6.44266 8.3291 6.57235 6.26074 8.17922 13.261 10.6014 12.757 17.9772 5.59151 numMergedOcc 0
55 mol 274 unq 12 iso 0 dist 8.75703 9.79674 10.7877 9.34663 5.68643 15.4145 13.5853 4.94221 13.1254 8.99974 numMergedOcc 0
56 mol 274 unq 13 iso 0 dist 8.75703 9.79674 10.7877 9.34663 5.68643 15.4145 10.0237 6.01628 11.5817 8.36043 numMergedOcc 0
57 mol 274 unq 14 iso 0 dist 8.75703 8.3291 4.97216 9.34663 5.68643 8.78883 13.5853 4.94221 8.19222 8.99974 numMergedOcc 0
58 mol 274 unq 15 iso 0 dist 8.75703 8.3291 4.97216 9.34663 5.68643 8.78883 10.0237 6.01628 10.2686 8.36043 numMergedOcc 0
59 mol 279 unq 0 iso 0 dist 8.78203 6.47376 5.86731 12.3869 8.76889 12.0882 14.3069 11.9542 12.8086 6.37469 numMergedOcc 0
60 mol 280 unq 0 iso 0 dist 7.3304 8.27417 4.95798 10.5216 9.9227 8.80588 12.9293 11.5166 14.1091 9.047 numMergedOcc 0
61 mol 282 unq 0 iso 0 dist 7.93511 6.84554 4.58403 8.96033 6.40686 10.161 13.5529 6.38894 10.5698 7.14443 numMergedOcc 0
62 mol 282 unq 1 iso 0 dist 7.93511 9.51581 5.04235 8.96033 6.40686 9.83042 13.5529 6.38894 8.37652 7.14443 numMergedOcc 0
63 mol 285 unq 0 iso 0 dist 8.08495 7.66291 8.39941 5.8542 8.33415 11.8098 12.5449 14.0317 19.4269 8.78148 numMergedOcc 0
