RDKit 3D 44 47 0 0 0 0 0 0 0 0999 V2000 4.4848 -1.6980 -0.8265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2537 -0.9440 -0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4575 -1.5315 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3338 -0.8604 0.9039 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9558 0.3521 0.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7549 0.9091 -0.6077 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9307 0.2631 -1.0267 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7286 0.8225 -1.9902 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2981 0.9074 0.9010 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6578 2.2603 0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3998 2.2518 -0.8548 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6729 1.4302 -0.6499 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2098 -0.0045 -0.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4945 -0.8189 -0.2645 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5583 -0.5637 -1.7024 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4318 -0.0904 0.7750 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9566 -1.4633 1.1537 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3551 -1.3428 1.9495 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1150 -0.3633 2.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0237 0.9116 2.4278 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7533 -2.4470 -0.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2283 -2.2678 -1.7441 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3547 -1.0265 -0.9826 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6932 -2.4775 1.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4723 1.8435 -1.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5673 0.3372 -2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3453 2.7154 1.2039 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2386 2.9038 0.4419 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8101 1.8844 -1.6924 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7703 3.3034 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0883 1.7390 0.3321 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3755 1.5595 -1.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9618 -0.4682 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1739 -0.6672 -1.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2043 -1.8875 -0.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2936 -0.4274 -2.5489 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5751 -0.1490 -1.9514 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5292 -1.6846 -1.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1566 0.1989 1.6007 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6928 -2.0371 0.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7057 -2.0297 1.7501 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6574 -2.2770 2.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9186 1.4635 2.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8679 1.4707 2.8594 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 7 8 1 0 5 9 1 0 9 10 1 6 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 13 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 7 2 1 0 16 9 1 0 18 4 1 0 20 9 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 6 25 1 0 8 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 12 32 1 0 14 33 1 0 14 34 1 0 14 35 1 0 15 36 1 0 15 37 1 0 15 38 1 0 16 39 1 1 17 40 1 0 17 41 1 0 18 42 1 1 20 43 1 0 20 44 1 0 M END