RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 -1.1094 2.4923 0.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8834 1.5808 -0.7536 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 1.4048 -1.0626 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9924 0.2199 -0.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3375 -0.1015 -0.3036 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2036 -0.0210 0.7553 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7433 0.3615 1.8614 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6628 -0.3692 0.6407 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1588 -0.8182 -0.6967 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5349 0.5694 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3187 -0.7978 1.7997 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0521 -0.9075 -0.5402 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6213 -2.2313 -0.3152 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7664 -2.7194 -0.8068 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.9636 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0562 -4.0499 1.1914 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4723 -2.2551 0.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1971 -0.8803 0.2762 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3762 -0.3788 -0.5246 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0094 0.8472 -1.3415 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2405 1.6794 -1.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2288 1.1833 -0.4283 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7850 2.1565 0.3751 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4772 0.1192 0.3299 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3455 -0.8586 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4612 0.0809 1.6921 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1168 2.7401 0.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2643 3.0430 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1623 2.3087 -0.8473 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6366 1.0643 -2.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 0.5326 0.8538 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2139 -0.4797 -0.8394 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1393 -1.9349 -0.7389 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4844 -0.3945 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5412 0.8266 1.0924 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0848 1.3117 2.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2451 -0.7946 -1.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4007 -2.1362 -1.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -3.7142 -0.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0944 -0.3741 1.2529 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7256 -1.1832 -1.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7327 0.5098 -2.3683 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0412 2.7642 -1.2628 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7057 1.5962 -2.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0812 0.6917 -0.9767 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1655 2.8430 -0.2275 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4247 -0.6432 1.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -1.9203 1.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 9 8 1 0 8 10 1 0 10 11 1 0 8 6 1 1 6 7 2 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 2 3 2 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 24 19 1 0 19 18 1 0 18 17 1 0 17 15 1 0 15 16 2 0 15 13 1 0 13 14 2 3 13 12 1 0 11 8 1 0 12 4 1 0 19 20 1 0 12 18 1 0 24 26 1 1 9 32 1 0 9 33 1 0 9 34 1 0 10 35 1 0 10 36 1 0 4 31 1 1 3 29 1 0 3 30 1 0 1 27 1 0 1 28 1 0 20 42 1 6 21 43 1 0 21 44 1 0 22 45 1 6 23 46 1 0 25 47 1 0 25 48 1 0 19 41 1 6 18 40 1 1 14 38 1 0 14 39 1 0 12 37 1 6 M END