B9Z2JB -OEChem-04012116532D 41 40 0 0 0 0 0 0 0999 V2000 3.0000 0.2842 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4118 2.5591 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.7842 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 11.7010 3.7158 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 6.5443 -2.5206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8335 0.2456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.7158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.7158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1871 0.7837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4333 2.3529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.2842 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 0.2842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.2842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3903 2.7653 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.2056 3.5376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6180 1.5806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5443 -0.9111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -2.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -1.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 0.0394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 -1.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1441 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1226 1.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.0958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 -2.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7479 -1.7158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 -1.0958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1236 1.8158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5303 1.2835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1432 0.7827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7364 1.3150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -3.7158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -3.7158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 1 12 2 0 0 0 0 1 13 2 0 0 0 0 2 10 1 0 0 0 0 2 14 1 0 0 0 0 2 15 2 0 0 0 0 2 16 2 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 25 1 0 0 0 0 6 27 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 29 1 0 0 0 0 9 25 2 0 0 0 0 10 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 2 0 0 0 0 18 20 2 0 0 0 0 18 25 1 0 0 0 0 19 22 2 0 0 0 0 20 26 1 0 0 0 0 21 23 1 0 0 0 0 21 30 1 0 0 0 0 22 24 1 0 0 0 0 22 31 1 0 0 0 0 23 24 2 0 0 0 0 26 32 1 0 0 0 0 26 33 1 0 0 0 0 26 34 1 0 0 0 0 27 28 1 0 0 0 0 27 35 1 0 0 0 0 27 36 1 0 0 0 0 28 37 1 0 0 0 0 28 38 1 0 0 0 0 29 39 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 M CHG 4 3 1 4 1 11 -1 14 -1 M END $$$$