IBS-ZINC05025104 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 0 0 0 0 0 0999 V2000 -0.5330 0.7510 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 0.9220 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 2.9740 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 3.5620 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 5.0920 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 5.6930 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 7.2220 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 7.8220 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 9.3510 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 9.9510 -2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 11.4630 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 12.1720 -2.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 13.5410 -2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 12.0890 -4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4430 11.6500 -4.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7680 12.3830 -5.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.3240 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 1.0060 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 1.0560 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 1.1390 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -0.1550 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 1.4030 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 3.2000 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 3.3650 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 3.2100 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 3.2270 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 5.4570 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 5.4270 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 5.3280 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 5.3570 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 7.5870 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 7.5570 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 7.4570 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 7.4880 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 9.7150 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 9.6890 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 9.5520 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 9.6720 -2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 13.9320 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 12.9060 -4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 11.9950 -6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 1.4670 0.9400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9730 1.2550 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 42 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END