PUBCHEM-ZINC05831120 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6650 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7500 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.9060 -1.7780 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.0280 -2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 1.1880 -3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 1.8560 -3.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 1.3390 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 0.1410 -3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -0.5520 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -1.7420 -2.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -2.3470 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -1.9100 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -3.0870 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -4.0860 -1.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -5.2310 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -5.4340 0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -6.2370 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -7.4240 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -8.3650 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -8.1310 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -6.9490 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -6.0080 -3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -6.7230 -5.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -5.4900 -5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -9.0580 -4.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -10.0560 -4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -9.5210 -1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -9.6950 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1300 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.7450 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.1910 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -1.7340 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 1.5990 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 2.7960 -4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 1.8790 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -0.2560 -3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -2.7520 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -3.5290 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -3.9240 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -7.6060 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -5.0930 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -5.4360 -6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -5.4340 -5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -4.6570 -5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -10.6220 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -9.5780 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -10.7310 -5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -10.6550 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -8.8930 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -9.6700 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M CHG 1 5 1 M END