PUBCHEM-ZINC05222036 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.1270 0.8300 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 1.2160 3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -0.2360 3.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -1.0420 4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -2.3930 4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -2.9520 4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -2.1610 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -0.8090 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 3.0450 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 3.3280 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 2.3370 -0.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 4.6690 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 5.7830 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 5.7160 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 6.7710 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 7.9280 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 8.0400 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 6.9860 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 7.2200 0.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 6.1550 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 5.0040 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 4.1870 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 4.4970 -3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 5.6390 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 6.4630 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 3.5900 -4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 2.5470 -3.9130 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 4.2230 -5.2810 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 3.0380 -4.7130 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -0.2470 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.1010 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 1.1490 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 1.8130 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 1.5670 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -0.6300 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -3.0120 5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -4.0040 4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -2.5980 3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -0.2120 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 3.3390 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 3.5450 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 4.8700 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 6.6990 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 8.7520 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 8.9650 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 3.3060 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 5.8970 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 7.3470 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 1.5340 1.9330 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8790 1.1840 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 49 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 49 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END