RDKit 3D 49 54 0 0 0 0 0 0 0 0999 V2000 2.8029 -0.9233 3.1041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1658 -0.2933 1.8362 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5211 0.9044 1.8061 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -0.8964 0.5998 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4972 -0.3332 -0.6038 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5947 -0.9124 -1.3607 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1103 -0.3893 -2.4678 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 0.7965 -3.1455 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 1.4168 -3.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4055 1.0250 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 1.7229 -2.3217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4346 1.1341 -1.1632 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4766 2.1736 0.3539 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4235 0.8185 1.7876 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9037 -0.5632 0.6961 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6940 -1.6136 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0933 -1.2015 0.9983 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1564 -1.6102 1.6601 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4858 -1.2883 1.4456 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0091 -0.1804 0.7526 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3128 0.8034 0.1768 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 0.9886 0.1141 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5930 1.8900 -0.9174 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0984 -0.2734 -0.1613 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7044 0.0525 -0.3793 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0031 0.7991 -1.3617 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5437 1.2021 -2.4154 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3509 -1.0205 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -2.1805 0.2307 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0621 -0.1528 -0.8559 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -0.1974 -1.5537 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2061 -0.2712 3.7732 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2526 -1.8774 2.9849 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7682 -1.1916 3.6256 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7803 0.7411 -0.3782 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0927 -1.8299 -1.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9194 -0.9310 -2.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 2.3334 -3.5873 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2544 2.8250 -2.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5421 1.6115 -3.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5861 -1.7341 2.4118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.5806 0.7852 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9833 -2.2862 2.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0679 -0.1361 0.6893 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 1.5348 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5456 1.4335 1.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3698 2.4961 -1.0181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5536 -0.7731 -1.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3643 -1.0620 -2.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 12 11 1 6 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 1 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 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 15 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 5 1 0 31 10 1 0 26 12 1 0 30 12 1 0 25 15 1 0 24 17 1 0 1 32 1 0 1 33 1 0 1 34 1 0 5 35 1 1 6 36 1 0 7 37 1 0 9 38 1 0 11 39 1 0 11 40 1 0 16 41 1 0 16 42 1 0 18 43 1 0 20 44 1 0 21 45 1 0 22 46 1 1 23 47 1 0 24 48 1 6 31 49 1 6 M END