RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 3.4340 -0.4696 1.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7547 -1.1776 -0.0351 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1752 -2.6365 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2101 -0.6742 -1.3797 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2831 -1.1338 0.1598 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0109 -1.7764 1.3671 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5642 -1.7506 -0.9596 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7993 -1.4119 -1.1854 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4253 -1.7502 -2.2043 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4267 -0.6161 -0.1044 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8589 -0.4254 -0.1718 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5533 -1.7852 -0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0412 -1.6071 -0.2019 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9026 -2.7285 -0.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -0.4350 -0.2744 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5678 0.5246 0.0538 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7492 0.2786 0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5731 1.3312 0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1259 2.5994 0.3603 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9579 3.6845 0.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4435 4.9521 0.5293 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0984 5.2267 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7397 4.1357 0.2396 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2246 2.8367 0.2232 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0666 1.7539 0.0679 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2928 2.0216 -0.0541 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3629 -1.0103 1.3847 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 0.5541 0.8088 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8187 -0.4026 2.0167 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1676 -2.7891 -0.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2159 -2.8769 1.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4336 -3.3273 -0.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0218 -1.4702 -2.1326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7977 0.2965 -1.6539 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3238 -0.5617 -1.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8847 -2.7438 1.1506 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0607 -2.4248 -1.5718 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2278 -1.2334 0.8332 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2336 0.0803 0.7709 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2951 0.1317 -0.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3004 -2.4106 -1.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3578 -2.3161 0.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5009 -3.6768 -0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9218 -2.6005 -0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0031 3.5038 0.6209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0999 5.8245 0.6521 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 6.2329 0.4073 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8132 4.2533 0.1266 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 3 1 0 2 4 1 0 2 5 1 0 5 6 1 1 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 2 0 10 16 1 0 16 25 1 0 25 26 2 0 25 24 1 0 24 23 2 0 23 22 1 0 22 21 2 0 21 20 1 0 20 19 2 0 19 18 1 0 18 17 2 0 17 5 1 0 17 16 1 0 19 24 1 0 1 27 1 0 1 28 1 0 1 29 1 0 3 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 4 35 1 0 6 36 1 0 7 37 1 0 10 38 1 1 11 39 1 0 11 40 1 0 12 41 1 0 12 42 1 0 14 43 1 0 14 44 1 0 23 48 1 0 22 47 1 0 21 46 1 0 20 45 1 0 M END