D00393 -OEChem-05072121502D 36 38 0 1 0 0 0 0 0999 V2000 4.6660 -2.3750 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3686 2.1195 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -3.2410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -3.2410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.8750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.8750 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.3981 0.6250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1777 0.7183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.4096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.3403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3468 2.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8468 1.4614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7535 3.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.0296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0881 -2.9119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -2.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7081 -1.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.2796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.5421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8612 0.9350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 0.9350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4634 1.3966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3199 2.9888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0057 3.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1871 3.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 5 13 1 0 0 0 0 5 32 1 0 0 0 0 6 17 2 0 0 0 0 7 12 1 0 0 0 0 7 15 1 0 0 0 0 8 17 1 0 0 0 0 8 20 1 0 0 0 0 8 31 1 0 0 0 0 9 20 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 13 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 19 1 0 0 0 0 16 28 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 M END $$$$