PUBCHEM-ZINC00717620 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.3080 1.4680 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0300 0.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9190 -0.5710 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -0.3200 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 0.3680 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 0.1110 2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -0.8290 3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -1.5220 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -1.2770 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -2.2640 2.4030 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.6300 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -0.2620 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 0.1970 5.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -0.7080 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -2.0720 5.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -2.5330 4.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 0.9580 2.8540 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -0.2050 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.6690 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.4200 -2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -1.9760 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.6700 -4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -4.1190 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -4.1680 -4.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -5.0490 -4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 2.0700 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 1.6580 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 1.8430 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 1.1170 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -1.0330 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.2620 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 0.4610 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 1.2590 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -0.3500 6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -2.7770 6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -3.6010 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 0.8740 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.7200 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.5580 -4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.0980 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -1.8860 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -3.4970 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -2.5410 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -2.1230 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -2.5540 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.0830 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -4.4360 -5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -4.7980 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.4890 -1.0290 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5430 0.0580 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -2.1220 -3.4760 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.7130 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 49 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 49 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 51 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 49 1 M CHG 1 51 1 M END