BV69QB -OEChem-04012115392D 45 48 0 0 0 0 0 0 0999 V2000 4.5274 3.3967 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3923 0.1257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7527 -1.1595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7515 -3.3967 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.1063 -2.8551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3347 -1.0887 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.9811 0.6069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 1.2818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 3.0411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 0.5361 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0852 -2.6509 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.6684 -0.3429 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3424 1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 1.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 3.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 2.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 1.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 2.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 2.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0321 2.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 0.7402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7316 -0.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0232 0.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3979 -1.7011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6895 -0.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3768 -1.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 0.4959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8724 0.7513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7081 1.1939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3034 0.6621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6208 2.7630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4518 1.9828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9426 3.6130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1806 3.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1633 1.8782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 2.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9008 3.0901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5719 1.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2171 0.7875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7899 -1.9593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5588 -1.7484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 20 1 0 0 0 0 2 21 2 0 0 0 0 3 26 1 0 0 0 0 3 45 1 0 0 0 0 4 11 1 0 0 0 0 5 11 2 0 0 0 0 6 12 1 0 0 0 0 7 12 2 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 20 1 0 0 0 0 9 22 2 0 0 0 0 10 24 2 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 27 43 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 30 44 1 0 0 0 0 M CHG 4 4 -1 6 -1 11 1 12 1 M END $$$$