NIH-ZINC04038818 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 1.5090 -8.8230 -3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -7.8760 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -7.9840 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -7.0990 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -6.1530 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -6.0380 -2.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -6.8390 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -6.4770 -4.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -5.4340 -4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -5.1750 -3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -4.2030 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -4.6180 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -3.5790 -1.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0070 -2.8160 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -4.3740 -1.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6820 -5.7050 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4590 -6.6290 -1.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -5.8360 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -7.0000 -2.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 -3.8110 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 -3.3910 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4110 -2.8720 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7680 -2.4830 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6780 -1.2520 -0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7720 -1.3580 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3580 -1.6900 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -2.9450 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -1.6690 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -1.1110 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -1.7250 1.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -2.9590 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -3.6050 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -3.0270 -3.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -4.7770 -5.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -9.5490 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -9.3820 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -8.2660 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -8.7470 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -7.2240 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -5.4640 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 -4.5800 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -2.9690 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 -2.5500 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2030 -4.2340 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4610 -3.8430 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0390 -2.1050 -2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4910 -2.3410 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1580 -3.2660 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7670 -0.3950 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1400 -2.1140 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9720 -0.9130 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6870 -1.8310 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -1.1180 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -0.1270 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -3.4360 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -4.6010 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -7.6740 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -4.7970 -5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -3.7340 -5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -5.2840 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3830 -2.9870 -1.1090 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.7080 -3.7420 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 2 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END