RDKit 3D 43 45 0 0 0 0 0 0 0 0999 V2000 5.4078 2.1638 0.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2202 0.7638 0.7591 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9667 0.2689 0.5091 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8696 1.1332 0.4321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6231 0.6205 0.1813 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4233 -0.7262 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1023 -1.2954 -0.2655 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0478 -2.5289 -0.4237 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0269 -0.5034 -0.3555 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2727 -1.1078 -0.6161 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1440 -0.7877 0.6097 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0911 0.7130 0.8110 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4968 1.2946 0.6462 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6996 1.1302 -0.8494 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2803 1.0025 -1.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9905 -0.4235 -1.7777 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4115 1.3740 -0.3128 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3889 2.6842 -0.0635 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5148 -1.5501 0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7861 -1.0871 0.3328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8994 -1.9117 0.4167 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7105 -3.3017 0.2353 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6964 2.4544 1.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1137 2.6396 -0.0112 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4487 2.3894 1.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9965 2.2036 0.5689 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7793 1.3004 0.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -2.1934 -0.7278 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1845 -1.1480 0.4427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6879 -1.3061 1.4808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6462 0.9922 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2331 0.7382 1.2432 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4676 2.3694 0.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2314 1.9753 -1.2954 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2264 0.1577 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1675 1.6992 -2.2649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4706 -0.5483 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9711 -0.9449 -1.8673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4996 2.8819 0.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3631 -2.6035 -0.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 -3.6305 0.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4609 -3.4936 -0.8223 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6158 -3.8583 0.5509 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 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 20 3 1 0 16 10 1 0 17 12 1 0 1 23 1 0 1 24 1 0 1 25 1 0 4 26 1 0 5 27 1 0 19 40 1 0 22 41 1 0 22 42 1 0 22 43 1 0 10 28 1 6 11 29 1 0 11 30 1 0 12 31 1 1 13 32 1 0 13 33 1 0 14 34 1 0 14 35 1 0 15 36 1 6 16 37 1 0 16 38 1 0 18 39 1 0 M END