NIH-ZINC04099697 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 0 0 0 0 0 0999 V2000 -0.1960 0.7740 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.5550 0.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -0.7210 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 0.3150 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 0.0400 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 -1.2930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -2.3300 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -2.0540 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -3.0500 0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -4.4150 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -5.0380 0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -5.1970 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -7.6190 1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -9.0230 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -9.0310 3.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -8.0540 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -6.6370 3.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -9.9260 4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -10.3240 5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -11.2230 6.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -11.7200 6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -11.2930 5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -1.4590 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 -2.7860 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 1.0360 -0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 2.3990 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 2.9900 -0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 3.1990 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 4.3320 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2150 5.1150 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4640 4.7750 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5980 3.6570 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 2.8680 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 0.7280 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 1.1970 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 1.4100 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 1.3390 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 -3.3510 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -2.6590 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -5.2930 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -4.7160 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -7.3120 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -7.5760 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -9.3130 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -9.7420 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -8.3060 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -8.0340 4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -5.9180 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -6.3220 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -9.9760 5.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -11.5380 7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -12.4220 7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -11.6500 5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -2.7330 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -3.4130 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 -3.2240 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 0.6570 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 4.6060 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 5.9910 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 5.3880 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5710 3.4060 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6120 2.0240 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -6.6040 1.8890 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6790 -6.8660 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -10.4230 4.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 63 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 13 63 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 18 65 2 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 22 65 1 0 0 0 0 23 24 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END