PUBCHEM-ZINC05791220 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.5260 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.0040 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.5340 0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4960 -2.0940 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.0360 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -2.7970 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.1290 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -4.6350 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2120 -4.2610 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -6.1420 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -6.8210 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -8.2030 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -8.9060 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -8.2270 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -6.8440 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -10.3860 -1.2570 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2910 -10.9850 -0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -11.0060 -1.5230 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6720 -4.1670 -2.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.1490 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -1.0060 -1.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 1.1450 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 1.4420 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 2.9580 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.9030 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.8790 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 1.8840 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -0.3630 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -0.3580 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -3.4130 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -3.4340 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -4.5030 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -4.4860 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -6.2720 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -8.7340 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -8.7760 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -6.3140 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -4.4620 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 0.9880 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 1.0400 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 3.3610 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 3.1810 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 3.4120 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -2.6640 0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -0.1050 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 3 45 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 44 2 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END