RDKit 3D 52 54 0 0 0 0 0 0 0 0999 V2000 0.7130 2.0799 2.1689 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.4524 1.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 3.8688 0.7317 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8243 3.8383 -0.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6286 2.5586 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5442 2.3976 -2.3514 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 1.6466 0.0201 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9235 1.1309 0.4678 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1761 0.0352 -0.5445 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0635 0.6450 -1.6246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9462 -1.0533 0.1639 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2323 -0.5230 0.7005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1359 -2.1496 -0.8699 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -2.7675 -1.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6181 -1.8856 -1.0241 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0470 -2.1685 0.1943 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8558 -0.4173 -1.0595 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1385 0.3480 -0.2692 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4026 0.4934 -0.7995 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6133 0.1069 -0.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5516 -0.4721 0.8129 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8822 0.3133 -0.9497 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9892 -0.1007 -0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0191 -0.9143 1.1647 S 0 0 0 0 0 3 0 0 0 0 0 0 6.4734 -1.9163 1.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9983 0.1646 2.4426 O 0 0 0 0 0 1 0 0 0 0 0 0 1.0965 2.8074 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8624 1.0259 2.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6682 4.5032 0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0166 4.2319 1.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6961 1.9134 0.4465 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7752 0.7107 1.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6031 0.4069 -2.6057 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0951 1.7546 -1.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 0.2076 -1.6257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3142 -1.4733 0.9656 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1512 -0.4444 1.8197 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0908 -1.2125 0.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5049 0.4814 0.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8372 -2.9165 -0.4873 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5329 -1.7458 -1.8242 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7101 -3.6347 -0.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8587 -3.2934 -2.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0955 -2.1950 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.9772 0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8122 -0.0899 -2.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2455 -0.1690 0.7088 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9276 0.8064 -1.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9456 0.0595 -0.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1324 -1.5743 2.1218 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1685 -2.9556 1.5289 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0385 -1.9387 0.3308 H 0 0 0 0 0 0 0 0 0 0 0 0 12 11 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 24 26 1 1 18 7 1 0 7 8 1 0 8 9 1 0 9 10 1 6 7 2 1 1 2 1 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 9 11 1 0 9 17 1 0 5 7 1 0 12 37 1 0 12 38 1 0 12 39 1 0 11 36 1 1 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 15 44 1 6 16 45 1 0 17 46 1 6 18 47 1 1 22 48 1 0 23 49 1 0 25 50 1 0 25 51 1 0 25 52 1 0 8 31 1 0 8 32 1 0 10 33 1 0 10 34 1 0 10 35 1 0 1 27 1 0 1 28 1 0 3 29 1 0 3 30 1 0 M CHG 2 24 1 26 -1 M END