PUBCHEM-ZINC04523472 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -1.4910 1.4280 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -0.0840 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -0.7880 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -2.2680 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -2.8550 -2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -2.9110 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -4.3550 0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6870 -4.8370 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -4.7530 -0.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8960 -5.8480 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -4.2780 0.4450 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9480 -4.7240 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -4.6390 1.9120 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7970 -5.7280 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -4.2340 2.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -4.8270 1.5650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4570 -5.9200 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -4.4380 2.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 -3.9690 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -4.4120 4.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -4.2540 4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -2.8630 0.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -2.7180 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -4.2600 -1.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -3.9250 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 2.1110 -3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 3.6220 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 1.8270 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.6510 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -0.2980 -2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -0.4890 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -0.6660 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -0.3530 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -2.3940 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -4.8610 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6330 -2.8800 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7680 -4.2310 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 1.7380 -4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 1.8470 -4.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 4.0370 -2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 3.9380 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 4.2290 -4.8230 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4380 5.2550 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 3.9500 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 3.9420 -5.3960 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 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END