ATOM 1 HO1 ROH 1 -3.330 9.458 -1.494 1.00 0.00 H ATOM 2 O1 ROH 1 -4.060 9.859 -1.973 1.00 0.00 O ATOM 3 C1 3YA 2 -3.492 11.042 -2.518 1.00 0.00 C ATOM 4 H1 3YA 2 -3.482 11.806 -1.741 1.00 0.00 H ATOM 5 C2 3YA 2 -4.297 11.575 -3.742 1.00 0.00 C ATOM 6 H2 3YA 2 -3.900 12.562 -3.984 1.00 0.00 H ATOM 7 C3 3YA 2 -4.113 10.672 -4.980 1.00 0.00 C ATOM 8 H3 3YA 2 -4.638 9.730 -4.802 1.00 0.00 H ATOM 9 C4 3YA 2 -2.634 10.371 -5.291 1.00 0.00 C ATOM 10 H4 3YA 2 -2.163 11.281 -5.665 1.00 0.00 H ATOM 11 C5 3YA 2 -1.861 9.849 -4.061 1.00 0.00 C ATOM 12 H5 3YA 2 -2.239 8.854 -3.819 1.00 0.00 H ATOM 13 C6 3YA 2 -0.344 9.715 -4.316 1.00 0.00 C ATOM 14 H62 3YA 2 -0.159 8.971 -5.091 1.00 0.00 H ATOM 15 H61 3YA 2 0.152 9.377 -3.405 1.00 0.00 H ATOM 16 O6 3YA 2 0.240 10.970 -4.726 1.00 0.00 O ATOM 17 H6O 3YA 2 1.194 10.880 -4.775 1.00 0.00 H ATOM 18 O5 3YA 2 -2.107 10.717 -2.862 1.00 0.00 O ATOM 19 O4 3YA 2 -2.601 9.362 -6.334 1.00 0.00 O ATOM 20 H4O 3YA 2 -3.254 9.628 -6.999 1.00 0.00 H ATOM 21 O2N 3YA 2 -6.183 13.478 -4.761 1.00 0.00 O ATOM 22 N2 3YA 2 -5.736 11.727 -3.414 1.00 0.00 N ATOM 23 H2N 3YA 2 -6.113 11.046 -2.770 1.00 0.00 H ATOM 24 C2N 3YA 2 -6.552 12.661 -3.918 1.00 0.00 C ATOM 25 CME 3YA 2 -8.007 12.634 -3.409 1.00 0.00 C ATOM 26 H3M 3YA 2 -8.026 12.536 -2.322 1.00 0.00 H ATOM 27 H2M 3YA 2 -8.520 13.556 -3.685 1.00 0.00 H ATOM 28 H1M 3YA 2 -8.534 11.789 -3.856 1.00 0.00 H ATOM 29 O3 3YA 2 -4.687 11.363 -6.161 1.00 0.00 O ATOM 30 C1 4LB 3 -5.689 10.631 -6.939 1.00 0.00 C ATOM 31 H1 4LB 3 -6.404 10.168 -6.257 1.00 0.00 H ATOM 32 O5 4LB 3 -5.012 9.573 -7.722 1.00 0.00 O ATOM 33 C5 4LB 3 -5.863 8.815 -8.680 1.00 0.00 C ATOM 34 H5 4LB 3 -6.672 8.339 -8.122 1.00 0.00 H ATOM 35 C6 4LB 3 -5.021 7.709 -9.338 1.00 0.00 C ATOM 36 H62 4LB 3 -4.155 8.133 -9.846 1.00 0.00 H ATOM 37 H61 4LB 3 -5.618 7.164 -10.069 1.00 0.00 H ATOM 38 O6 4LB 3 -4.566 6.792 -8.329 1.00 0.00 O ATOM 39 H6O 4LB 3 -4.047 7.272 -7.675 1.00 0.00 H ATOM 40 C4 4LB 3 -6.482 9.811 -9.680 1.00 0.00 C ATOM 41 H4 4LB 3 -7.154 9.278 -10.355 1.00 0.00 H ATOM 42 H2O 4LB 3 -6.775 12.973 -6.409 1.00 0.00 H ATOM 43 C3 4LB 3 -7.296 10.870 -8.899 1.00 0.00 C ATOM 44 H3 4LB 3 -8.095 10.352 -8.365 1.00 0.00 H ATOM 45 O3 4LB 3 -7.922 11.800 -9.818 1.00 0.00 O ATOM 46 H3O 4LB 3 -8.310 12.512 -9.293 1.00 0.00 H ATOM 47 C2 4LB 3 -6.431 11.632 -7.865 1.00 0.00 C ATOM 48 H2 4LB 3 -5.705 12.261 -8.383 1.00 0.00 H ATOM 49 O2 4LB 3 -7.308 12.480 -7.065 1.00 0.00 O ATOM 50 O4 4LB 3 -5.382 10.454 -10.446 1.00 0.00 O ATOM 51 C1 0YA 4 -5.236 10.019 -11.848 1.00 0.00 C ATOM 52 H1 0YA 4 -5.255 8.929 -11.875 1.00 0.00 H ATOM 53 C2 0YA 4 -3.873 10.485 -12.429 1.00 0.00 C ATOM 54 H2 0YA 4 -3.742 9.975 -13.385 1.00 0.00 H ATOM 55 C3 0YA 4 -3.846 12.010 -12.695 1.00 0.00 C ATOM 56 H3 0YA 4 -3.807 12.527 -11.733 1.00 0.00 H ATOM 57 C4 0YA 4 -5.081 12.505 -13.484 1.00 0.00 C ATOM 58 H4 0YA 4 -5.013 12.155 -14.515 1.00 0.00 H ATOM 59 C5 0YA 4 -6.400 12.009 -12.854 1.00 0.00 C ATOM 60 H5 0YA 4 -6.492 12.468 -11.870 1.00 0.00 H ATOM 61 C6 0YA 4 -7.657 12.400 -13.656 1.00 0.00 C ATOM 62 H62 0YA 4 -7.764 13.485 -13.674 1.00 0.00 H ATOM 63 H61 0YA 4 -8.543 11.987 -13.173 1.00 0.00 H ATOM 64 O6 0YA 4 -7.598 11.918 -15.018 1.00 0.00 O ATOM 65 H6O 0YA 4 -8.415 12.145 -15.467 1.00 0.00 H ATOM 66 O5 0YA 4 -6.351 10.525 -12.661 1.00 0.00 O ATOM 67 O4 0YA 4 -5.063 13.953 -13.475 1.00 0.00 O ATOM 68 H4O 0YA 4 -4.174 14.212 -13.748 1.00 0.00 H ATOM 69 O3 0YA 4 -2.651 12.357 -13.454 1.00 0.00 O ATOM 70 H3O 0YA 4 -2.013 11.618 -13.429 1.00 0.00 H ATOM 71 N2 0YA 4 -2.755 10.077 -11.540 1.00 0.00 N ATOM 72 H2N 0YA 4 -2.957 10.034 -10.553 1.00 0.00 H ATOM 73 C2N 0YA 4 -1.499 9.863 -11.948 1.00 0.00 C ATOM 74 CME 0YA 4 -0.501 9.372 -10.878 1.00 0.00 C ATOM 75 H3M 0YA 4 -0.982 8.660 -10.206 1.00 0.00 H ATOM 76 H2M 0YA 4 0.347 8.881 -11.357 1.00 0.00 H ATOM 77 H1M 0YA 4 -0.139 10.224 -10.301 1.00 0.00 H ATOM 78 O2N 0YA 4 -1.158 10.066 -13.110 1.00 0.00 O TER 79 0YA 4 END