IBS-ZINC02328018 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -0.4600 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -0.9740 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -1.1780 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -1.7320 -4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -2.0960 -5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -1.9040 -4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -1.3430 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -1.0290 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -1.2360 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.0130 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 0.0830 -4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 1.2040 -5.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 2.2310 -4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 2.1350 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 1.0100 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 3.4240 -1.9100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6340 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -0.3610 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.1220 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -1.2720 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -1.7290 5.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -2.0400 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -1.8910 4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -1.4420 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -2.4890 6.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -2.7900 6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -0.8970 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -1.8870 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -2.5320 -6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -2.1890 -4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -2.1010 -3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -1.4100 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -0.7190 -5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 1.2790 -6.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 3.1070 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 0.9330 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.7070 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -1.0300 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -1.8450 6.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -2.1330 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -1.3320 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 -3.1380 7.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -3.5680 5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -1.8930 6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END