RDKit 3D 106109 0 0 0 0 0 0 0 0999 V2000 13.0012 1.5944 1.5447 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3767 2.2517 0.3731 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2287 1.7252 -0.8691 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6637 2.5766 -1.9342 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7812 0.6413 -1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2383 -0.5343 -0.6145 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2957 -1.2065 -1.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0439 -1.4020 -1.2749 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3799 -0.9992 -0.0513 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0656 -1.2222 0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -0.7026 1.4646 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5656 -0.6813 2.2473 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 0.6104 1.8481 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5831 0.5305 0.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 0.5358 -0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1842 0.6271 0.4916 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9946 0.7140 1.7168 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 0.6212 -0.2599 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7157 0.7080 0.3259 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0276 1.9433 -0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3497 1.7041 -0.7449 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5548 1.8874 0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5107 1.2499 1.4528 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 1.7906 2.2259 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2695 0.2269 1.8775 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5544 0.0415 2.3136 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6006 0.9262 1.7773 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4684 2.2442 1.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4499 3.1976 1.1966 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7424 2.6253 0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5264 1.9013 1.7683 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5976 3.7520 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9189 -1.4383 2.1573 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4228 -1.7990 0.7952 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5913 -2.7686 0.8562 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1458 -2.8595 -0.5475 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0649 -2.5026 -1.5766 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4497 -3.1253 -2.8965 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7822 -3.0621 -1.0424 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6503 -3.0211 -2.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9213 -1.6900 -2.0636 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8704 -0.7345 -2.1011 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0401 0.0067 -3.2139 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9102 -1.6692 -0.9829 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8603 -0.5586 -1.1638 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0362 -0.5673 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3929 0.5984 -1.5629 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4129 -2.4584 0.1165 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0206 -0.1544 1.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 -0.3696 0.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5138 0.6326 1.7128 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3221 2.2340 2.4159 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8765 1.5133 1.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2147 2.1838 -2.6969 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9227 -0.4807 0.4182 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1234 -1.2775 -0.5784 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6623 -1.5652 -2.5118 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3972 -1.9182 -2.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7722 -0.5890 3.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9116 -1.5167 1.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5121 1.4821 2.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9726 0.7187 2.5168 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4759 0.4589 -0.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4254 0.4688 -1.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8777 0.7833 1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1503 2.6993 0.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6732 2.4778 -0.8201 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4509 2.5575 -1.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 2.9911 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4302 1.5844 -0.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6197 0.1836 3.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5496 0.5452 1.4025 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5115 2.6515 2.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6114 3.9790 1.9813 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9487 3.7601 0.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5129 1.8761 -0.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4864 2.4671 1.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0094 1.8538 2.7579 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9004 0.8943 1.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3025 4.0483 0.9534 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9592 4.5706 -0.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1921 3.2832 -0.6726 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0546 -2.0727 2.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7233 -1.7205 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7786 -0.8994 0.2977 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1509 -3.7763 1.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3499 -2.4762 1.6059 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5808 -3.8694 -0.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9432 -2.0772 -0.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0569 -1.4080 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0943 -2.4361 -3.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9375 -4.0866 -3.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5454 -3.1984 -3.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0054 -4.1401 -0.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0756 -3.2707 -3.0292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9596 -3.8585 -1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3627 -1.7096 -3.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2145 0.6076 -3.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 0.7580 -2.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -0.6265 -4.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2717 -1.5450 0.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3341 -2.6158 -1.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2097 -0.9471 -2.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6035 -0.8559 0.9739 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -1.3788 -0.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1844 0.3471 2.8582 H 0 0 0 0 0 0 0 0 0 0 0 0 43 42 1 0 42 41 1 0 41 44 1 0 44 45 1 0 45 46 1 0 46 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 39 48 1 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 21 47 1 0 19 18 1 0 18 16 1 0 16 17 2 0 16 15 1 0 15 14 2 0 14 13 1 0 13 12 1 0 12 11 1 0 11 49 2 0 49 50 1 0 50 9 1 0 9 8 1 0 8 7 2 0 7 6 1 0 6 5 1 0 5 3 2 0 3 4 1 0 3 2 1 0 2 1 1 0 9 10 2 0 40 41 1 0 10 11 1 0 47 45 1 0 48 34 1 0 43 98 1 0 43 99 1 0 43100 1 0 41 97 1 6 44101 1 0 44102 1 0 45103 1 6 46104 1 0 46105 1 0 19 65 1 1 20 66 1 0 20 67 1 0 21 68 1 6 22 69 1 0 22 70 1 0 26 71 1 1 33 83 1 0 33 84 1 0 34 85 1 6 35 86 1 0 35 87 1 0 36 88 1 0 36 89 1 0 37 90 1 6 38 91 1 0 38 92 1 0 38 93 1 0 39 94 1 1 40 95 1 0 40 96 1 0 27 72 1 0 28 73 1 0 29 74 1 0 29 75 1 0 30 76 1 0 31 77 1 0 31 78 1 0 31 79 1 0 32 80 1 0 32 81 1 0 32 82 1 0 15 64 1 0 14 63 1 0 13 61 1 0 13 62 1 0 12 59 1 0 12 60 1 0 49106 1 0 8 58 1 0 7 57 1 0 6 55 1 0 6 56 1 0 4 54 1 0 1 51 1 0 1 52 1 0 1 53 1 0 M END