HEADER NONAME 29-Oct-18 NONE 1 TITLE NONE 2 COMPND 5997 NONE 3 AUTHOR Apache NONE 4 REVDAT 1 29-Oct-18 0 NONE 5 ATOM 1 O 0 7.500 1.583 -0.320 0.00 0.00 O+0 ATOM 2 C 0 -0.818 -1.108 -0.203 0.00 0.00 C+0 ATOM 3 C 0 -0.119 -0.437 0.996 0.00 0.00 C+0 ATOM 4 C 0 1.407 -0.565 0.958 0.00 0.00 C+0 ATOM 5 C 0 1.948 0.060 -0.361 0.00 0.00 C+0 ATOM 6 C 0 -2.292 -0.844 0.189 0.00 0.00 C+0 ATOM 7 C 0 -0.351 -0.384 -1.473 0.00 0.00 C+0 ATOM 8 C 0 3.519 -0.082 -0.467 0.00 0.00 C+0 ATOM 9 C 0 -0.872 -0.982 2.206 0.00 0.00 C+0 ATOM 10 C 0 1.180 -0.433 -1.619 0.00 0.00 C+0 ATOM 11 C 0 -2.323 -1.129 1.709 0.00 0.00 C+0 ATOM 12 C 0 2.042 0.130 2.171 0.00 0.00 C+0 ATOM 13 C 0 -3.351 -1.621 -0.581 0.00 0.00 C+0 ATOM 14 C 0 -0.536 -2.626 -0.328 0.00 0.00 C+0 ATOM 15 C 0 4.190 0.269 0.868 0.00 0.00 C+0 ATOM 16 C 0 4.025 0.900 -1.565 0.00 0.00 C+0 ATOM 17 C 0 3.510 0.371 2.024 0.00 0.00 C+0 ATOM 18 C 0 3.930 -1.526 -0.843 0.00 0.00 C+0 ATOM 19 C 0 5.682 0.513 0.848 0.00 0.00 C+0 ATOM 20 C 0 5.542 1.079 -1.600 0.00 0.00 C+0 ATOM 21 C 0 -4.787 -1.276 -0.134 0.00 0.00 C+0 ATOM 22 C 0 6.080 1.507 -0.240 0.00 0.00 C+0 ATOM 23 C 0 -3.211 -1.351 -2.084 0.00 0.00 C+0 ATOM 24 C 0 -5.186 0.203 -0.234 0.00 0.00 C+0 ATOM 25 C 0 -6.595 0.492 0.293 0.00 0.00 C+0 ATOM 26 C 0 -7.021 1.964 0.126 0.00 0.00 C+0 ATOM 27 C 0 -6.961 2.432 -1.328 0.00 0.00 C+0 ATOM 28 C 0 -6.132 2.861 0.992 0.00 0.00 C+0 ATOM 29 H 0 -0.342 0.643 0.962 0.00 0.00 H+0 ATOM 30 H 0 1.683 -1.625 1.001 0.00 0.00 H+0 ATOM 31 H 0 1.729 1.138 -0.292 0.00 0.00 H+0 ATOM 32 H 0 -2.468 0.232 0.054 0.00 0.00 H+0 ATOM 33 H 0 -0.668 0.667 -1.452 0.00 0.00 H+0 ATOM 34 H 0 -0.759 -0.815 -2.387 0.00 0.00 H+0 ATOM 35 H 0 -0.813 -0.306 3.065 0.00 0.00 H+0 ATOM 36 H 0 -0.476 -1.954 2.521 0.00 0.00 H+0 ATOM 37 H 0 1.468 -1.458 -1.867 0.00 0.00 H+0 ATOM 38 H 0 1.458 0.181 -2.483 0.00 0.00 H+0 ATOM 39 H 0 -2.687 -2.138 1.935 0.00 0.00 H+0 ATOM 40 H 0 -2.983 -0.420 2.220 0.00 0.00 H+0 ATOM 41 H 0 1.875 -0.486 3.064 0.00 0.00 H+0 ATOM 42 H 0 1.560 1.097 2.360 0.00 0.00 H+0 ATOM 43 H 0 -3.228 -2.699 -0.418 0.00 0.00 H+0 ATOM 44 H 0 -0.984 -3.047 -1.233 0.00 0.00 H+0 ATOM 45 H 0 0.532 -2.851 -0.383 0.00 0.00 H+0 ATOM 46 H 0 -0.930 -3.194 0.521 0.00 0.00 H+0 ATOM 47 H 0 3.574 1.890 -1.409 0.00 0.00 H+0 ATOM 48 H 0 3.697 0.566 -2.557 0.00 0.00 H+0 ATOM 49 H 0 4.037 0.644 2.934 0.00 0.00 H+0 ATOM 50 H 0 3.610 -1.787 -1.857 0.00 0.00 H+0 ATOM 51 H 0 5.015 -1.669 -0.822 0.00 0.00 H+0 ATOM 52 H 0 3.501 -2.263 -0.155 0.00 0.00 H+0 ATOM 53 H 0 6.043 0.885 1.816 0.00 0.00 H+0 ATOM 54 H 0 6.209 -0.437 0.698 0.00 0.00 H+0 ATOM 55 H 0 6.033 0.154 -1.929 0.00 0.00 H+0 ATOM 56 H 0 5.810 1.831 -2.353 0.00 0.00 H+0 ATOM 57 H 0 -5.497 -1.872 -0.722 0.00 0.00 H+0 ATOM 58 H 0 -4.922 -1.603 0.905 0.00 0.00 H+0 ATOM 59 H 0 5.705 2.508 0.005 0.00 0.00 H+0 ATOM 60 H 0 -3.037 -0.294 -2.307 0.00 0.00 H+0 ATOM 61 H 0 -4.128 -1.641 -2.611 0.00 0.00 H+0 ATOM 62 H 0 -2.427 -1.962 -2.534 0.00 0.00 H+0 ATOM 63 H 0 -4.475 0.806 0.336 0.00 0.00 H+0 ATOM 64 H 0 -5.107 0.508 -1.282 0.00 0.00 H+0 ATOM 65 H 0 7.828 1.860 0.553 0.00 0.00 H+0 ATOM 66 H 0 -6.657 0.208 1.350 0.00 0.00 H+0 ATOM 67 H 0 -7.312 -0.142 -0.243 0.00 0.00 H+0 ATOM 68 H 0 -8.056 2.055 0.480 0.00 0.00 H+0 ATOM 69 H 0 -7.510 1.746 -1.982 0.00 0.00 H+0 ATOM 70 H 0 -7.421 3.422 -1.425 0.00 0.00 H+0 ATOM 71 H 0 -5.935 2.517 -1.699 0.00 0.00 H+0 ATOM 72 H 0 -6.107 2.509 2.029 0.00 0.00 H+0 ATOM 73 H 0 -6.526 3.884 1.001 0.00 0.00 H+0 ATOM 74 H 0 -5.104 2.916 0.621 0.00 0.00 H+0 CONECT 1 22 65 0 0 NONE 80 CONECT 2 3 6 7 14 NONE 81 CONECT 3 2 4 9 29 NONE 82 CONECT 4 3 5 12 30 NONE 83 CONECT 5 4 8 10 31 NONE 84 CONECT 6 2 11 13 32 NONE 85 CONECT 7 2 10 33 34 NONE 86 CONECT 8 5 15 16 18 NONE 87 CONECT 9 3 11 35 36 NONE 88 CONECT 10 5 7 37 38 NONE 89 CONECT 11 6 9 39 40 NONE 90 CONECT 12 4 17 41 42 NONE 91 CONECT 13 6 21 23 43 NONE 92 CONECT 14 2 44 45 46 NONE 93 CONECT 15 8 17 19 0 NONE 94 CONECT 16 8 20 47 48 NONE 95 CONECT 17 12 15 49 0 NONE 96 CONECT 18 8 50 51 52 NONE 97 CONECT 19 15 22 53 54 NONE 98 CONECT 20 16 22 55 56 NONE 99 CONECT 21 13 24 57 58 NONE 100 CONECT 22 1 19 20 59 NONE 101 CONECT 23 13 60 61 62 NONE 102 CONECT 24 21 25 63 64 NONE 103 CONECT 25 24 26 66 67 NONE 104 CONECT 26 25 27 28 68 NONE 105 CONECT 27 26 69 70 71 NONE 106 CONECT 28 26 72 73 74 NONE 107 END NONE 108