PUBCHEM-ZINC04904972 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.1180 1.5310 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.0050 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0470 -0.4180 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.3770 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -1.8640 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -2.5300 2.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -2.4510 -0.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6190 -1.9820 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -2.1040 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -0.2490 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -0.1230 -3.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8310 -1.1200 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 0.6930 -4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 2.0970 -4.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 2.8400 -5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 2.1940 -7.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 0.7970 -7.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 0.0440 -6.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 0.1060 -8.2140 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1300 0.7990 -9.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -1.1300 -8.1700 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7730 0.4500 -3.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -3.9590 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.9520 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.8740 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 1.9660 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 0.1090 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.0690 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -2.4420 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -2.5450 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 0.7030 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -1.0170 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 2.6290 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 3.9270 -5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 2.7930 -7.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -1.0450 -6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 0.7770 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -4.4740 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -4.3610 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -4.2070 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -0.5980 -1.3420 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3460 -0.1530 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 41 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 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 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 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 41 1 M END