ASINEX-ZINC00850078 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.6310 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.0400 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 0.6570 -2.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 0.9420 -3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 0.3900 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -0.2370 -2.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -0.9660 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 0.0000 -0.6010 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7920 0.5130 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -0.7810 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 0.1030 1.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2180 -0.4360 1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5090 -1.7670 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5280 -2.3350 2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2650 -1.5810 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9960 -0.2080 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9560 0.3730 2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6840 1.7440 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4170 2.4940 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4360 1.9230 4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7360 0.6000 4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 0.9610 -1.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 0.5480 -4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 0.0720 -4.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 1.2310 -5.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 1.3420 -6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 1.7610 -5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 2.3710 -6.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 1.6330 -4.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 2.2250 -4.8740 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 -1.4130 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -1.7510 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -1.2210 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 -1.5720 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 -2.3880 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7390 -3.3900 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0520 -2.0370 3.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 2.2010 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2060 3.5490 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0040 2.5400 5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5300 0.1700 4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 0.5750 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 1.5000 -5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 3.1130 -5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 2.5030 -3.9140 H 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 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 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 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 M END