PUBCHEM-ZINC05138732 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -4.1370 1.8300 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 0.4000 -4.5560 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7760 0.4230 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -0.3250 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 0.3470 -7.3440 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -0.4940 -8.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -0.3780 -3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -1.1420 -3.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -0.1760 -2.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 0.5110 -1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5370 0.0350 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -0.1550 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -0.6590 -0.8520 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2220 -2.1980 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 -2.8230 -1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -3.0060 -0.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7060 -2.6630 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -3.0240 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -4.3670 -0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -5.3360 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -5.1580 1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -6.6640 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -7.5930 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -8.9470 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -9.6130 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -8.7010 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -7.3410 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -0.0030 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -0.3730 0.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 2.4550 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3850 2.3120 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 1.8370 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -0.2730 -5.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 -1.3870 -5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 1.5880 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8040 0.2790 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2130 0.7440 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 -0.9230 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 0.8140 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 -0.8530 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.0240 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -3.6530 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -3.4270 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -4.5560 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -6.4420 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -7.7510 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -7.1230 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -9.6010 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -8.8110 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -9.8760 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -10.5490 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -9.1810 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -8.5580 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 -6.7050 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -7.4660 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 0.8710 -1.2060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 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 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 M CHG 1 56 -1 M END