RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 3.9268 -2.7467 1.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5896 -1.6412 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7514 -1.7273 0.0023 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9835 -0.4912 -0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 0.3684 -0.2442 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0643 -0.3750 0.4855 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8238 0.1289 1.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7457 0.3922 0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5182 -0.4505 -1.0566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.1683 -1.9768 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3517 0.9384 -1.8306 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1152 1.7709 -0.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9051 1.5000 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3073 1.1353 -2.7727 N 0 0 0 0 0 2 0 0 0 0 0 0 -2.7048 1.8475 -2.5309 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7734 3.0780 -1.7569 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7385 1.6147 -3.5289 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5083 0.8347 -1.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7742 0.9820 -0.7693 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9474 -0.0316 0.1865 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8212 -0.7522 0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9565 -0.2513 -0.5982 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.1498 -0.2526 0.9649 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9877 2.1700 -1.1762 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5002 -3.6733 1.2508 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9211 -2.9284 0.9643 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8559 -2.5131 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8784 -0.2858 -1.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7798 1.4055 -0.4951 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0917 1.0508 1.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4556 -0.5851 1.8016 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1471 -1.3204 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3881 -0.8278 -2.8389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6983 2.6790 -0.5763 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0482 2.1915 1.0219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6455 -1.5938 0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9947 -0.5395 -0.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9877 -0.4516 0.2913 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3573 0.6323 1.5724 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0109 -1.1136 1.6245 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 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 11 14 1 0 14 15 1 0 15 16 2 0 15 17 2 0 15 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 2 0 20 23 1 0 19 24 1 0 6 2 1 0 13 8 1 0 22 18 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 7 30 1 0 7 31 1 0 9 32 1 0 10 33 1 0 12 34 1 0 13 35 1 0 21 36 1 0 22 37 1 0 23 38 1 0 23 39 1 0 23 40 1 0 M CHG 2 14 -1 22 1 M END