PUBCHEM-ZINC00449777 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1870 -2.3900 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -2.5200 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -2.5340 -1.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -3.7620 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.4490 -0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -4.2830 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -5.6690 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -5.8370 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -7.1080 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -8.2120 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -8.0440 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -6.7730 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -9.5730 1.2180 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8750 -9.7210 2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -10.5450 0.5110 O 0 5 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -2.1570 -3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -2.1430 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -3.6100 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -1.9850 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -3.6230 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -4.3180 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -4.9750 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -7.2400 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -8.9060 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -6.6420 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END