RDKit 3D 55 57 0 0 0 0 0 0 0 0999 V2000 -5.0741 -2.8006 -3.3429 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5135 -3.2210 -1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -2.0906 -1.1086 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3426 -1.3391 -1.1211 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3676 -1.5579 -1.8399 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3539 -0.2178 -0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4071 0.1828 0.7639 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9997 1.2422 1.5753 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4415 1.7921 1.1417 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2515 0.6191 -0.0514 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0879 0.5334 -0.8123 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0565 1.3029 -0.6805 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 2.1955 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 0.8429 -1.6038 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0352 -0.2367 -0.9698 N 0 0 0 0 0 4 0 0 0 0 0 0 2.9056 0.2231 0.1812 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9288 -0.9352 1.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7906 -0.6617 2.4349 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8321 0.4489 2.2742 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2754 0.6522 0.8485 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3278 0.5813 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7454 0.8837 -1.5075 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0803 1.2071 -1.7715 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0087 1.2550 -0.7334 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6062 0.9936 0.5764 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7107 1.8600 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 1.3625 3.2584 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2515 3.0740 3.1283 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7563 -0.4782 0.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1714 -3.6631 -4.0134 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4245 -2.0578 -3.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0545 -2.3333 -3.2224 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5252 -3.6800 -2.1033 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1692 -3.9677 -1.5326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1411 -0.1840 -1.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8354 1.6886 -1.8557 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7859 0.4215 -2.5283 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6393 -0.6860 -1.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4032 -0.9757 -0.6354 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4304 1.0970 0.6376 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3146 -1.8420 0.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9091 -1.1812 1.5233 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2945 -1.5958 2.7115 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1471 -0.4148 3.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6901 0.2250 2.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4079 1.3934 2.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0667 0.8914 -2.3518 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4019 1.4387 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0455 1.5172 -0.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3388 1.0684 1.3807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 3.5231 3.8867 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4814 3.5558 2.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6749 -1.4287 1.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1666 -0.6714 -0.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4952 0.1483 1.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 8 26 1 0 26 27 2 0 26 28 1 0 7 29 1 0 10 6 2 0 21 16 1 0 25 20 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 11 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 16 40 1 1 17 41 1 0 17 42 1 0 18 43 1 0 18 44 1 0 19 45 1 0 19 46 1 0 22 47 1 0 23 48 1 0 24 49 1 0 25 50 1 0 28 51 1 0 28 52 1 0 29 53 1 0 29 54 1 0 29 55 1 0 M CHG 1 15 1 M END