RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 5.6946 -0.4672 -0.8969 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4703 -1.1717 -1.0177 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3067 -0.4925 -0.6816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3089 0.8144 -0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1046 1.4606 0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9316 0.7999 -0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8776 -0.5249 -0.4647 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0954 -1.1366 -0.7834 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0995 -2.4619 -1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2136 -3.4809 -0.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3352 -1.3287 -0.5876 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2888 -1.9151 -1.8756 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -0.6251 -0.4417 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5412 0.7433 0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7688 1.3643 0.4454 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8072 2.6342 0.9243 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5984 3.3010 1.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3741 2.7283 0.7535 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3547 1.4142 0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6178 3.6551 1.0163 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0166 4.9003 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3507 4.5955 1.5343 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9697 0.5266 0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7345 -0.8670 0.7484 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5012 -1.4627 0.3616 N 0 0 1 0 0 4 0 0 0 0 0 0 -2.7259 -2.7497 -0.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8107 -1.7965 1.5016 O 0 0 0 0 0 1 0 0 0 0 0 0 5.7750 -0.1667 0.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 0.4829 -1.4627 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5644 -1.0929 -1.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2564 1.3400 -0.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1716 2.4572 0.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -4.3227 -0.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2423 -3.9116 -0.2543 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -3.0909 0.7759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2401 -2.1868 0.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -1.3035 -2.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1162 -0.5268 -1.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 3.1298 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0882 5.5099 0.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4941 5.4287 2.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7942 0.9640 0.8581 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 0.4538 -0.8318 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8683 -0.9244 1.8536 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5582 -1.5017 0.3331 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9426 -2.5407 -1.3671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6123 -3.2369 0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8384 -3.4179 -0.1719 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 4 5 1 0 5 6 2 0 6 7 1 0 7 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 15 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 1 15 16 1 0 16 17 2 0 17 22 1 0 22 21 1 0 21 20 1 0 20 18 1 0 18 19 2 0 7 8 2 0 8 9 1 0 9 10 1 0 8 3 1 0 19 6 1 0 25 13 1 0 18 17 1 0 19 14 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 5 32 1 0 11 36 1 1 12 37 1 0 13 38 1 6 23 42 1 0 23 43 1 0 24 44 1 0 24 45 1 0 26 46 1 0 26 47 1 0 26 48 1 0 16 39 1 0 21 40 1 0 21 41 1 0 10 33 1 0 10 34 1 0 10 35 1 0 M CHG 2 25 1 27 -1 M END