PUBCHEM-ZINC04217270 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 1.3870 -0.8520 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.7320 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.9540 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -1.8250 0.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7930 -2.6580 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -0.9820 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -1.0980 -1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -3.8940 -0.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0980 -4.2190 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -4.5650 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -4.1730 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -3.3760 -2.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -5.3150 -1.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -5.7070 -3.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6090 -5.9080 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -4.6640 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -4.6050 -2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -5.9750 -2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -6.9610 -2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -7.0440 -2.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0130 -7.7130 -3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -7.5890 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -6.3380 -0.8110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4900 -6.5060 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -5.9560 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -4.7160 0.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -1.4270 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -0.0020 2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.4660 3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.1280 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -2.5870 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.4920 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.1250 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -4.1600 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -5.6410 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -4.4340 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 -4.9260 -4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -3.6590 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 -3.8860 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -4.2480 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 -6.3250 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -5.9130 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -7.9580 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -6.6730 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -8.0500 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -8.3550 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -0.3470 0.5420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.4040 -0.6500 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0530 -2.0650 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -1.9150 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -6.9230 1.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 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 1 0 0 0 0 4 6 1 0 0 0 0 4 48 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 48 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 47 -1 M CHG 1 48 1 M CHG 1 51 -1 M END