RDKit 3D 43 45 0 0 0 0 0 0 0 0999 V2000 1.7887 2.6093 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 1.2561 2.3824 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 1.0414 1.1506 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2769 0.2579 1.1083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3453 -0.0265 -0.1182 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2127 0.5044 -1.2992 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3828 1.2750 -1.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0055 1.5149 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1533 2.2690 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2945 1.4114 -0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0016 1.8069 -2.3676 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2961 1.7705 -3.6005 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6264 -0.8564 -0.1903 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4146 -2.2291 0.4377 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7660 -3.2878 -0.4067 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5517 -4.3000 -0.6463 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8062 -4.0507 -0.0179 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7336 -2.8876 0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7531 -2.2819 1.1578 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7454 -0.8687 1.1547 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8101 -0.1614 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9323 1.2592 0.3736 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0626 2.4071 0.2702 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8167 -0.3455 1.8334 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6423 -3.1628 -0.8949 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7193 -2.3652 -1.9932 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2044 -4.3508 -1.2378 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4529 -2.6125 0.0462 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7284 2.8895 2.7404 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4001 3.3075 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 2.6836 3.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1309 -0.1029 2.0503 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2731 0.2943 -2.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3901 0.8559 0.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1822 2.0423 -0.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2623 0.7196 -0.8694 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2049 0.7435 -3.9685 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8781 2.3348 -4.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3141 2.2498 -3.5134 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8908 -0.9851 -1.2506 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9444 -2.2165 1.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 -1.0018 1.9073 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1153 0.5891 1.5594 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 7 11 1 0 11 12 1 0 5 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 3 0 20 24 1 0 15 25 1 0 25 26 1 0 25 27 1 0 25 28 1 0 8 3 1 0 21 13 1 0 18 14 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 0 6 33 1 0 10 34 1 0 10 35 1 0 10 36 1 0 12 37 1 0 12 38 1 0 12 39 1 0 13 40 1 6 14 41 1 1 24 42 1 0 24 43 1 0 M END