PUBCHEM-ZINC05482339 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 1.3760 0.8540 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.3340 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.0510 1.8710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5540 -0.2710 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -0.9790 1.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1070 -0.0580 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -0.8340 -0.2500 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -2.1540 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -3.3650 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 -4.4480 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -4.3530 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -3.1830 2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -2.0680 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 -0.9350 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -0.8940 4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 -1.9890 4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -3.1260 3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 1.3840 2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 1.9760 1.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -1.5410 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.2040 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 0.5790 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 1.7040 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -3.4830 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -5.3680 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -5.2130 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -0.0560 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -0.0050 5.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 -1.9620 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -3.9790 3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -1.3150 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -2.4410 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -1.7940 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -1.0200 2.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.9550 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.7950 3.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 36 -1 M END