RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 5.9658 0.5779 -0.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8145 -0.1993 -0.1286 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5271 0.2807 -0.4114 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4516 1.5924 -0.7862 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 2.1040 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1253 3.4288 -1.4244 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 1.3030 -0.9738 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -0.0465 -0.5956 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -0.5406 -0.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5388 -1.8622 0.0896 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4298 -2.2124 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0639 -0.8071 -0.5396 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2707 -0.3151 -0.9941 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2236 -1.2962 -0.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2412 -1.6185 0.8949 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0192 -2.6560 1.3908 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8078 -3.3864 0.4923 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -3.0579 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0116 -2.0265 -1.3338 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9646 -1.6465 -2.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4109 1.0732 -0.5430 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4501 1.4210 0.7688 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4627 2.2895 1.2617 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6936 2.7975 2.5892 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2696 2.6772 0.3313 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2855 1.8366 -1.2259 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4812 2.8294 -1.9321 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 0.5116 -1.2534 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8559 1.6290 0.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7482 0.0779 0.4334 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2748 2.2591 -0.8718 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3136 3.9217 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8241 -3.2254 1.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -1.5000 2.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3378 -2.2868 1.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2376 -0.4039 -2.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6126 -1.1049 1.6538 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0557 -2.9618 2.4418 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4496 -4.2176 0.8428 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -3.6043 -1.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4823 -2.0411 -3.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3542 1.4693 -1.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 2.1922 3.4488 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8117 2.8508 2.7677 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4005 3.8943 2.6897 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 9 2 0 9 10 1 0 10 11 1 0 9 8 1 0 8 7 2 0 7 5 1 0 5 6 1 0 5 4 2 0 7 26 1 0 26 27 2 0 26 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 2 0 21 13 1 0 13 12 1 0 13 14 1 0 14 19 2 0 19 20 1 0 19 18 1 0 18 17 2 0 17 16 1 0 16 15 2 0 4 3 1 0 15 14 1 0 12 8 1 0 1 28 1 0 1 29 1 0 1 30 1 0 11 33 1 0 11 34 1 0 11 35 1 0 6 32 1 0 4 31 1 0 21 42 1 6 24 43 1 0 24 44 1 0 24 45 1 0 13 36 1 6 20 41 1 0 18 40 1 0 17 39 1 0 16 38 1 0 15 37 1 0 M END