NIH-ZINC04103328 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 78 0 0 1 0 0 0 0 0999 V2000 -0.7670 2.6850 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 1.3350 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 1.1890 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.0590 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -1.1640 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.0350 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 0.2170 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.2180 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -3.4160 -2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -3.5610 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -4.6460 -0.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.4230 -0.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -2.5290 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.6600 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -4.1290 -4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -4.3530 -5.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0060 -5.0500 -6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -3.0480 -5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4620 -2.5770 -4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 -3.8830 -3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 -4.8580 -4.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -6.5880 -4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -7.5460 -3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -7.7280 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -7.3830 -3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -7.2930 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -8.4020 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -6.5040 -6.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -5.3780 -6.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -5.7090 -8.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -7.0180 -8.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -7.5270 -7.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -8.9620 -6.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -9.5110 -6.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -10.6810 -5.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -11.3040 -5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 3.1880 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 2.5950 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 3.3100 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 2.0500 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -0.1520 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 0.3310 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -2.0950 -4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -5.3780 -3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -4.4690 -4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -3.4010 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -3.6120 -5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 -3.2650 -6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -2.3130 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 -1.8940 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 -2.0700 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 -4.2180 -4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -3.8250 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -7.2350 -4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -8.5470 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -6.8070 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -8.4770 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 -7.8810 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -6.4150 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -8.3170 -4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -6.8440 -5.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -9.0770 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -7.4180 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -8.8410 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -9.3860 -7.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -9.2600 -6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -8.7840 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -9.7600 -7.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -10.6210 -5.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -11.6240 -6.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -12.1850 -5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -5.2210 -3.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -8.2460 -2.2920 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6140 -9.1880 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 72 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 72 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 28 1 0 0 0 0 22 72 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 73 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 73 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 73 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 35 36 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 73 74 1 0 0 0 0 M CHG 1 73 1 M END