RDKit 3D 43 47 0 0 0 0 0 0 0 0999 V2000 5.0124 2.2321 -0.1509 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6336 0.8733 -0.0848 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2819 0.5124 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3398 1.5013 -0.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9706 1.1578 -0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6131 -0.1742 0.0126 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5701 -1.1657 0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9078 -0.8061 0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8717 -1.7957 0.0445 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4593 -3.1430 0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7879 -0.5264 0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2208 -1.8516 0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5741 -2.1215 0.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5114 -1.1249 0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1212 0.1927 0.1102 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7688 0.4683 0.0813 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4301 1.9117 0.0836 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0187 2.2402 -0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3229 2.5146 -0.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6334 2.5903 -0.3083 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1516 1.2502 0.1077 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6907 -3.5083 0.1616 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 -4.0491 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5765 -3.0357 0.1175 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 2.7377 -0.9796 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0878 2.3310 -0.2904 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6497 2.7108 0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5872 2.5610 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3206 -2.1689 0.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8703 -3.3553 1.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7817 -3.3231 -0.7515 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3289 -3.8275 0.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -1.3535 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7954 2.3502 1.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2583 3.0762 0.6011 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1107 2.7370 -1.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3588 1.8269 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5066 3.2261 0.6094 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3383 3.1024 -1.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5876 1.3148 1.1213 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9906 0.9770 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2316 -5.0304 0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4334 -4.0353 -1.4354 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 8 2 0 8 9 1 0 9 10 1 0 6 11 1 0 11 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 15 1 0 15 14 2 0 14 13 1 0 13 12 2 0 12 24 1 0 24 23 1 0 23 22 1 0 8 3 1 0 12 11 1 0 18 5 1 0 22 13 1 0 15 16 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 7 29 1 0 10 30 1 0 10 31 1 0 10 32 1 0 17 34 1 1 18 35 1 0 18 36 1 0 19 37 1 0 20 38 1 0 20 39 1 0 21 40 1 0 21 41 1 0 14 33 1 0 23 42 1 0 23 43 1 0 M END