NIH-ZINC01813679 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.6350 1.6030 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 0.5510 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 2.8770 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 3.7280 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 4.9860 -0.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 6.2650 -1.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0600 6.1590 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 7.1580 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 8.6050 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 9.0960 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 10.1970 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 10.6520 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 10.0130 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 8.9280 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 8.4730 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 8.0900 0.6920 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 10.3650 -1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 11.4710 -2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 9.4070 0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 6.5090 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 6.9780 1.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 5.0920 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 4.2150 0.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 6.6930 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 7.1050 -3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 7.5430 -4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 7.5720 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 7.1680 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 6.7290 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 7.9980 -6.2840 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 0.5880 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 2.0580 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 2.1990 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 0.9380 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.4160 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 0.4590 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 3.3720 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 2.6860 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 3.9430 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 3.1800 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 10.6960 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 11.5040 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 7.6440 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 11.2730 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 12.3910 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 11.6130 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 6.2190 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 7.1000 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 7.8690 -5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 7.2040 -4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 6.4270 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 1.5220 -1.1330 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1120 1.1310 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 52 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 52 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 20 2 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END