IBS-ZINC02160599 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -2.5710 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.8990 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -4.6740 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -4.4200 0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9560 -4.0590 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -3.9270 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -5.8850 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 -6.6470 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -6.2640 -1.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -8.0750 -0.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0260 -8.8920 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -9.5660 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -10.2330 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -11.0680 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -11.5370 -4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -11.1960 -5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -10.3720 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -9.8870 -3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -9.0710 -2.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -8.6780 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -12.3510 -4.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -12.8080 -5.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -9.5950 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -9.0640 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -7.9340 0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -6.6380 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -6.1900 1.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 -8.7290 -0.1200 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -1.9500 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -2.8370 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 -4.3040 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -4.2880 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -11.3330 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -11.5880 -6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -10.1150 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -13.4480 -5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -13.3730 -5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -11.9520 -6.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -10.6200 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -8.9740 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -9.8480 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -8.7320 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -8.7400 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 -9.7510 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 -8.1610 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 8 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 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END