PUBCHEM-ZINC02893747 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.8440 0.8830 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.5600 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -1.4160 -0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -0.9480 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -2.2910 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -2.6970 -1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -1.7830 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -0.4370 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -0.0180 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -2.1800 -1.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -1.5130 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -2.5470 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -4.2800 -2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -3.2420 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3870 -4.5700 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 -5.4670 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1800 -6.7930 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8590 -7.6190 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7540 -7.6240 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5150 -8.4280 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3840 -9.2440 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4810 -9.2580 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 -8.4440 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 -8.4690 -1.7240 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.6300 -9.5310 -2.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 -7.4290 -1.9240 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9180 0.9810 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.5010 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 1.2280 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -3.0410 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -3.7590 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 0.3290 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 1.0410 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 -0.8430 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -0.9070 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 -3.0840 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8880 -2.0570 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4710 -4.9790 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -4.8160 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 -2.7810 -3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -3.7550 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1850 -3.9630 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 -5.1170 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3250 -4.9820 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6280 -7.3270 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6560 -7.0160 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2220 -8.4250 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2130 -9.8710 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 -9.8980 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3810 -3.5920 -1.5260 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.8420 -3.0970 -2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 50 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 50 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M CHG 1 50 1 M END