BJ4QE5 -OEChem-04012114533D 32 33 0 0 0 0 0 0 0999 V2000 4.3287 -2.0911 -0.3034 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3524 0.2567 -1.2729 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6837 -0.8620 -0.1173 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6697 0.1166 0.5936 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5312 0.3374 1.5113 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 0.2377 1.3692 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8231 0.2598 0.7624 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1804 0.0609 0.4698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5141 -0.8786 0.5903 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3511 1.4866 0.1899 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7503 1.1680 -0.1589 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 -1.2100 0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5098 1.5094 -0.4861 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 0.2451 -0.6633 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8578 1.0042 -0.9911 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8253 -1.3739 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3953 -0.2668 -1.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -0.8737 0.1236 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6553 0.8511 -0.2224 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5205 -0.4228 2.3038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4465 1.3025 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0426 1.2158 1.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0172 -0.5073 2.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -1.8357 0.9756 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7844 2.4034 0.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3393 2.1629 -0.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2817 -2.0803 0.7494 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9074 2.4224 -0.9125 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3012 1.8660 -1.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2437 -2.3635 -0.7245 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2574 -0.3945 -1.8425 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0911 -2.2811 -1.2273 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 32 1 0 0 0 0 2 14 2 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 24 1 0 0 0 0 10 13 2 0 0 0 0 10 25 1 0 0 0 0 11 15 1 0 0 0 0 11 26 1 0 0 0 0 12 16 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 15 17 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 M END $$$$