B9DJB4 -OEChem-04012118142D 35 35 0 1 0 0 0 0 0999 V2000 10.2663 -3.9936 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 6.4162 -0.5041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6418 3.5696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2889 -3.7825 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.6545 -2.0895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1328 0.6590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4032 0.3489 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1408 2.2685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1931 1.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1881 0.9685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4144 2.5958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4387 -0.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4384 2.3782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7204 1.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7221 -1.4562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6996 -1.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4294 0.5763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0055 -2.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9830 -2.8304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0006 2.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8245 -0.3773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4151 -0.9126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4415 2.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8346 2.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3404 1.4577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5381 -0.2563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1079 -1.5405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6985 -2.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3138 -1.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7232 -1.0478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0404 0.0935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3912 -2.7036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9818 -3.2389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 3.9936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 12 1 0 0 0 0 3 35 1 0 0 0 0 4 20 1 0 0 0 0 5 20 2 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 7 11 1 0 0 0 0 7 18 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 14 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 M CHG 2 1 1 4 -1 M END $$$$