PUBCHEM-ZINC04544474 MOE2007 3D CORINA 3.40 0006 02.08.2006 75 76 0 0 1 0 0 0 0 0999 V2000 -0.0620 -2.4970 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -1.7240 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -1.9300 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.2340 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.0110 2.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8180 -0.6440 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -0.3630 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 0.5160 4.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -1.6550 3.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -1.9950 5.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5340 -1.2540 5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -2.0080 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6170 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 0.2480 5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 1.5240 5.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 1.9340 3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 1.0700 2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -0.2080 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -3.3570 5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -3.9820 5.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -3.8800 6.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -5.2050 7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -5.5540 8.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -5.2100 9.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -5.5310 10.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -6.1970 10.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -6.5420 9.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -6.2250 8.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -6.5110 11.9710 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.3940 2.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 1.7970 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 0.9820 1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 3.2600 1.8210 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5880 3.7120 2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 3.9600 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 5.4650 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 6.2950 -0.5590 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 8.0400 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 3.4040 1.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 2.9170 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 2.3590 -0.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.0690 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -3.5430 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -2.4280 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -2.0890 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -1.5650 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -1.3800 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -2.9920 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 0.3280 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 0.1060 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -2.3590 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -2.3470 5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -2.6840 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -0.0730 6.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 2.1990 6.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 2.9320 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 1.3910 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -0.8850 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -3.3800 7.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -5.1960 7.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -5.9460 6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -4.6900 9.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -5.2610 11.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -7.0620 9.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -6.4970 7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 2.0350 2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 3.7780 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 3.5690 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 5.6470 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 5.8560 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 8.6440 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 8.1580 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 8.3660 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 3.8510 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 3.0230 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 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 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 12 53 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 54 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 16 17 2 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 58 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 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 60 1 0 0 0 0 22 61 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 62 1 0 0 0 0 25 26 1 0 0 0 0 25 63 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 64 1 0 0 0 0 28 65 1 0 0 0 0 30 31 1 0 0 0 0 30 66 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 39 1 0 0 0 0 35 36 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 37 38 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 38 73 1 0 0 0 0 39 40 1 0 0 0 0 39 74 1 0 0 0 0 40 41 2 0 0 0 0 40 75 1 0 0 0 0 M END