B87KWG -OEChem-04012118212D 44 48 0 0 0 0 0 0 0999 V2000 2.0000 -2.1040 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1040 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5561 -0.9359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2686 1.4630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6183 2.5450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7251 -0.8452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -1.9087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8578 2.2693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -0.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 0.6512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8066 0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6146 0.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5602 0.6758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2686 1.4613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8083 1.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1452 -0.1352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -2.8593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 -0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9701 1.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1401 -0.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9650 1.6890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5500 0.8780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7200 -0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 -1.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6672 2.8593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1091 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 -3.0519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0476 -3.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4443 -2.6667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6074 2.0908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2191 2.2545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1668 0.9406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7826 -1.3610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3368 -0.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6573 -0.1273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 24 1 0 0 0 0 3 20 1 0 0 0 0 3 23 1 0 0 0 0 4 17 2 0 0 0 0 5 18 2 0 0 0 0 6 27 1 0 0 0 0 6 30 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 22 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 2 0 0 0 0 10 12 2 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 19 2 0 0 0 0 12 15 1 0 0 0 0 12 18 1 0 0 0 0 13 21 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 23 2 0 0 0 0 16 20 2 0 0 0 0 16 25 1 0 0 0 0 19 24 1 0 0 0 0 19 32 1 0 0 0 0 20 27 1 0 0 0 0 21 26 1 0 0 0 0 21 33 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 35 1 0 0 0 0 24 26 2 0 0 0 0 25 28 2 0 0 0 0 25 39 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 40 1 0 0 0 0 29 41 1 0 0 0 0 30 42 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 M END $$$$