IBS-ZINC06658472 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 1.8020 -0.6190 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -0.5550 -1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -1.6830 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -0.6260 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.4100 -0.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4340 -1.0730 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -0.7630 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 0.2510 1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.9820 -1.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 1.4800 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 0.8080 -3.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 2.9760 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 3.5490 -3.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 3.1450 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 3.4370 -4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 2.8200 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 3.2830 -1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 2.9280 -5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 3.2610 -4.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 4.5620 -5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 5.4280 -5.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2230 4.8880 -4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7550 6.1670 -4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0460 6.4490 -4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7990 5.4560 -3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2650 4.1780 -3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9740 3.9000 -4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4380 2.6270 -3.8600 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9800 1.8990 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1790 2.2640 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7980 1.1100 -4.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -0.5400 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 0.2040 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -1.5610 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 0.4050 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.6650 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -1.6170 -2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.6360 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -1.6010 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 0.1260 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 1.5620 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 3.4720 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 4.6440 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 3.2450 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 3.6840 -5.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 2.0790 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 4.5260 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 3.1060 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 1.7250 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 2.8280 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 4.3670 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 3.3820 -6.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 1.8440 -5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1740 6.9460 -5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4650 7.4430 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8050 5.6780 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8660 3.4160 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -1.9940 0.8830 O 0 5 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 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 58 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 M CHG 1 58 -1 M END