RDKit 3D 43 48 0 0 0 0 0 0 0 0999 V2000 4.4878 1.4144 0.7806 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 0.2982 0.1255 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -0.6472 0.5020 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5500 -1.9515 0.1181 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5917 -2.9226 0.1152 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9395 -4.1306 0.0862 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1931 -2.4779 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8857 -1.1906 0.1826 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5473 -0.8182 0.1104 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9965 -1.2666 -1.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4533 -1.5095 1.0751 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6072 -2.1553 0.5747 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7276 -0.9129 1.3041 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1606 0.2786 0.4918 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1952 0.0003 -0.4045 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0764 1.1313 -0.0335 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1828 2.5953 0.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9004 1.2106 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7241 1.1473 -2.4429 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5078 1.3917 -1.7245 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1441 1.5254 -0.5314 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5586 1.0706 -0.3837 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6918 0.9906 1.1252 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8917 -0.1195 0.2048 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6920 0.6415 0.3784 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8605 1.7200 1.6137 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2811 2.0947 0.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9711 0.0402 -0.6838 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3351 -0.6804 1.6476 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4223 -3.2486 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0665 -1.2904 -1.4273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3782 -0.8615 -2.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7056 -2.3711 -1.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9282 -1.9956 1.9214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2383 -1.1227 2.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6943 0.9366 1.2623 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 -0.7549 -0.0542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7967 3.2993 -0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7127 2.6914 1.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2689 2.7895 0.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 2.5558 -0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3035 1.7863 -0.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5052 0.8179 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 16 17 1 1 16 25 1 0 25 21 1 0 21 20 1 0 20 18 1 0 18 19 2 0 21 22 1 0 22 23 1 0 24 23 1 1 24 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 1 6 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 3 2 1 0 2 1 2 3 18 16 1 0 24 22 1 0 8 24 1 0 13 11 1 0 14 16 1 0 9 25 1 0 17 38 1 0 17 39 1 0 17 40 1 0 25 43 1 1 21 41 1 1 22 42 1 6 3 29 1 1 7 30 1 0 10 31 1 0 10 32 1 0 10 33 1 0 11 34 1 1 13 35 1 1 14 36 1 1 15 37 1 0 2 28 1 0 1 26 1 0 1 27 1 0 M END