B4BMR8 -OEChem-04022104073D 29 31 0 0 0 0 0 0 0999 V2000 1.7557 1.8282 -0.3193 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 1.9270 0.8943 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8949 -2.8287 0.3354 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5493 -1.1254 0.1498 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2869 1.0032 -0.1527 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5263 -0.5011 0.0109 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6468 0.2127 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9729 -0.4267 0.0218 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7127 -0.6469 0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1023 -0.1777 -0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.9102 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1921 -1.8405 0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7858 0.1306 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4433 1.1055 0.3847 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0809 -1.0203 -0.5701 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7629 1.5462 0.2846 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4005 -0.5795 -0.6702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9375 0.5527 -0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4707 1.8361 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7416 0.7037 -0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3307 0.2110 -0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7079 1.1066 -0.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8674 -2.8154 0.3602 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8438 -2.0216 -0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0282 2.5453 0.6174 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1623 -1.2344 -1.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0292 2.7527 -0.4338 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7689 1.0471 -0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5071 -1.3339 0.1909 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 19 1 0 0 0 0 2 14 1 0 0 0 0 3 12 2 0 0 0 0 4 21 1 0 0 0 0 4 29 1 0 0 0 0 5 21 2 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 8 13 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 14 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 16 20 1 0 0 0 0 16 25 1 0 0 0 0 17 20 2 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 27 1 0 0 0 0 20 28 1 0 0 0 0 M END $$$$