NCID-ZINC05706602 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3850 -2.1700 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -4.0960 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -4.7770 -0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.6820 1.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -6.1420 1.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1550 -6.5510 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -6.5390 2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 -6.0930 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -6.5630 5.2730 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -5.9600 5.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -6.6880 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -5.9350 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -2.2080 -1.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -0.9980 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 -0.2260 -0.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 -0.6440 -2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 0.6750 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 0.8930 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2870 0.5330 -4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 0.7330 -5.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1410 1.2940 -6.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 1.6550 -6.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 1.4580 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -4.1360 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -7.6210 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -6.0570 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -5.0110 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 -6.5740 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -6.4450 5.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -6.1920 7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -4.8820 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 -2.8240 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 0.7480 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 1.4330 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 0.0950 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9030 0.4510 -5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 1.4490 -7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 2.0920 -6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 1.7440 -4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -8.0120 0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -8.3140 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END