PUBCHEM-ZINC05068280 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2070 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 2.1780 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6280 3.3960 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 1.5860 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -2.0600 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -2.6240 -0.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5160 -2.2140 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 -4.1480 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 -6.1450 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 -6.6420 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9360 -7.9510 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -8.2040 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -6.8000 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 -2.2640 -1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -2.4080 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.3990 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -4.4230 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -4.5640 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 -6.4780 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 -5.9020 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -6.8290 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9300 -7.8470 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 -8.7740 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3760 -8.6200 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 -8.8700 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -6.8790 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -6.2420 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -2.5960 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2640 -4.6800 0.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8290 -4.3850 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 29 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END