RDKit 3D 47 48 0 0 0 0 0 0 0 0999 V2000 8.8300 2.2711 0.8604 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7179 1.3117 0.5627 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1337 0.5702 1.5957 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0718 -0.2935 1.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5798 -0.4014 0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1506 0.3309 -1.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 1.1926 -0.7424 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2319 -1.5026 -0.3018 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0712 -1.6439 -1.7295 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 -2.6439 0.5754 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9243 -0.5764 0.2186 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -1.3871 0.5855 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4954 -0.5148 0.4511 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4188 0.4533 -0.2983 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5135 -0.9668 1.2283 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7033 -0.1914 1.1214 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8289 -0.7569 1.9911 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6466 -1.5630 2.8941 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0591 -0.2049 1.7245 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9385 -0.9677 1.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6862 -2.0681 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1182 -0.2957 0.7954 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2193 -0.9090 0.0823 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5617 -0.0582 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8235 0.5048 -2.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7407 1.1903 -2.9281 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9797 1.0013 -2.3654 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8814 0.2531 -1.2404 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4385 1.9183 1.6949 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4166 3.2487 1.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4937 2.3867 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5051 0.6590 2.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6303 -0.8731 2.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7759 0.2424 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 1.7733 -1.5506 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6765 0.0887 -0.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5996 -2.2339 -0.0955 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8339 -1.7279 1.6176 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5054 0.8304 1.4681 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0431 -0.1774 0.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0336 0.7208 1.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3626 0.4195 1.4646 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0589 -0.9711 0.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9692 -1.9259 -0.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7547 0.4240 -2.2277 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5287 1.7475 -3.8291 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9795 1.3159 -2.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 5 8 1 0 8 9 2 0 8 10 2 0 8 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 7 2 1 0 28 24 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 4 33 1 0 6 34 1 0 7 35 1 0 11 36 1 0 12 37 1 0 12 38 1 0 16 39 1 0 16 40 1 0 19 41 1 0 22 42 1 0 23 43 1 0 23 44 1 0 25 45 1 0 26 46 1 0 27 47 1 0 M END