NIH-ZINC03959018 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.8300 1.4390 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 0.1400 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -0.8960 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -0.5530 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 0.7020 1.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 1.6690 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.3120 0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3250 -2.3350 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.3350 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -2.9070 2.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -2.5000 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -2.5190 3.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -2.0130 4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -1.9010 5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -1.3500 6.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -0.0100 6.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -0.1040 4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -0.6640 3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -1.8070 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -2.3000 -2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -3.6150 -3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -4.5500 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -4.1890 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 2.2530 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -0.0500 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -1.2940 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 2.6650 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -4.2720 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -3.5690 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -2.9130 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -2.7560 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.8850 6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.2470 5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -2.0700 6.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -1.2320 7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 0.3260 6.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 0.7450 6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -0.7470 4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 0.8880 4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 0.0580 3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -0.7650 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -0.8210 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -1.7770 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -1.6390 -3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 -2.2940 -2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -5.5390 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -4.5890 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -4.1960 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -4.8810 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -2.7740 -0.8840 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2480 -2.7660 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 50 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END