RDKit 3D 55 58 0 0 0 0 0 0 0 0999 V2000 9.0178 -2.2729 -2.6656 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9609 -1.9555 -1.6519 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2421 -1.1087 -0.5762 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2425 -0.7820 0.3445 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9297 -1.2513 0.1998 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6711 -2.1299 -0.8573 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6666 -2.4636 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9978 -0.9231 1.1781 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5745 -1.0280 0.9417 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9341 -0.3050 -0.1492 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3017 0.8577 0.1758 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 0.9233 1.4536 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7869 -0.3448 2.4401 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3619 2.2948 2.1963 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0259 1.4947 3.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8993 0.7274 2.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8816 -0.5002 1.9955 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7324 1.5108 1.3057 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6372 0.9763 0.2765 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8785 0.3447 0.9412 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9691 -0.0006 -0.0247 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1561 0.6112 -0.1546 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8556 1.6308 0.5627 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0139 2.0909 0.0605 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5545 1.5986 -1.1979 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9314 0.6807 -1.9604 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6579 0.1412 -1.4583 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8742 -0.6934 -2.0195 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.7087 -0.9501 -1.1629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0955 2.0764 -0.7421 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 1.6363 -1.8612 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0251 3.2587 -0.3088 O 0 0 0 0 0 1 0 0 0 0 0 0 8.7668 -3.1743 -3.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1238 -1.4375 -3.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9801 -2.4524 -2.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2453 -0.7034 -0.4383 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5005 -0.1381 1.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6908 -2.5756 -0.9934 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4185 -3.1344 -2.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2115 -0.0654 1.6756 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2923 -2.0829 0.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5798 -0.1901 -0.9244 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3301 0.8139 3.8121 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6323 2.2616 3.5291 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6039 2.5229 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0798 0.2086 -0.2764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2611 1.0335 1.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5871 -0.5626 1.4842 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4363 2.0366 1.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5580 2.8827 0.5715 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4917 2.0406 -1.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3354 0.3563 -2.9091 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0161 -1.0324 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7406 -1.9947 -0.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8057 -0.7579 -1.7432 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 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 19 30 1 0 30 31 2 0 30 32 1 0 7 2 1 0 13 9 1 0 29 21 1 0 27 22 1 0 1 33 1 0 1 34 1 0 1 35 1 0 3 36 1 0 4 37 1 0 6 38 1 0 7 39 1 0 8 40 1 0 9 41 1 6 10 42 1 0 15 43 1 0 15 44 1 0 18 45 1 0 19 46 1 6 20 47 1 0 20 48 1 0 23 49 1 0 24 50 1 0 25 51 1 0 26 52 1 0 28 53 1 0 29 54 1 0 29 55 1 0 M CHG 2 28 1 32 -1 M END