PUBCHEM-ZINC02571879 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 47 0 0 1 0 0 0 0 0999 V2000 -1.2240 1.6990 -1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 0.4990 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 0.9950 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.4720 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -1.8100 -0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9070 -1.6650 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -2.5650 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -3.5120 -0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -2.0620 1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -2.5690 1.9430 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3020 -2.9500 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -3.6490 3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -4.9650 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -6.2370 3.7620 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -7.6190 2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -1.3590 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -0.3410 2.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8070 -1.4950 2.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3290 -0.7250 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 -2.3210 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -2.6840 -0.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.7260 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -2.0690 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -3.6760 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 2.3880 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 1.3720 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 2.2550 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.0030 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 0.1770 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 1.7210 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 1.4830 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 0.0440 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -0.6860 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -1.2770 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -3.2820 3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -3.8250 3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -5.3110 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -4.8430 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -7.8460 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -7.3810 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -8.5030 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -3.2900 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -4.7030 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -3.5810 -3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -3.3700 -2.3890 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0410 -4.0960 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -3.2550 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.4700 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 45 1 M END