RDKit 3D 44 45 0 0 0 0 0 0 0 0999 V2000 8.4854 -0.4739 -0.5885 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0928 -0.5500 -0.5882 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3284 0.0508 0.4014 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8944 0.6754 1.3152 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9156 -0.0830 0.3147 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1036 0.5384 1.3401 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 0.3000 1.0961 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9315 1.1844 0.3375 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5649 1.0058 0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1241 -0.0724 0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4591 -0.3382 0.3733 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3116 0.4581 -0.3633 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3773 0.9685 0.3867 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3725 0.0264 0.6155 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3843 0.6467 1.5382 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0932 -0.3500 -0.6628 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2923 0.3446 -0.8146 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2295 0.0120 -1.8800 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2505 1.3733 -2.1093 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8231 -0.3883 -1.5204 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9836 -0.2753 -2.6269 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6344 -0.9784 1.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9682 -0.7829 1.5919 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8946 -1.2108 -1.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 0.5488 -0.8256 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8687 -0.7092 0.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 -0.6034 -0.4461 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3049 1.6042 1.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3529 0.0252 2.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3924 2.0701 -0.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.7357 -0.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 1.3313 -0.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9226 -0.8387 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8447 1.2326 2.3216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 1.3740 1.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0512 -0.1097 2.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2628 -1.4352 -0.6364 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9045 -0.2793 -1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6039 -0.5712 -2.7211 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1588 1.6886 -2.3496 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8544 -1.4524 -1.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1645 -0.8485 -2.5021 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0874 -1.8283 1.7389 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5347 -1.4841 2.1904 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 10 22 1 0 22 23 2 0 23 7 1 0 20 12 1 0 1 24 1 0 1 25 1 0 1 26 1 0 5 27 1 0 6 28 1 0 6 29 1 0 8 30 1 0 9 31 1 0 12 32 1 6 14 33 1 1 15 34 1 0 15 35 1 0 15 36 1 0 16 37 1 1 17 38 1 0 18 39 1 6 19 40 1 0 20 41 1 1 21 42 1 0 22 43 1 0 23 44 1 0 M END