PUBCHEM-ZINC02172680 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.5020 1.8380 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 0.7750 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -0.0230 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 0.2280 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 1.3120 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 2.1060 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -0.6260 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -1.1660 -2.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5860 -0.3560 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 -1.9150 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 -3.1440 -1.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -2.0710 -2.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -1.7120 -3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -0.6030 -4.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -2.8260 -3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -2.4490 -5.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -3.2580 -5.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -4.3550 -5.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -2.6920 -7.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -3.2120 -9.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -4.1740 -10.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -5.2240 -10.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -6.1280 -11.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -5.9950 -12.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -4.9600 -12.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -4.0560 -11.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 2.4560 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.5660 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -0.8450 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 1.5380 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.9300 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 -0.0220 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -1.4740 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -3.0160 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -3.7620 -4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -2.9670 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -1.5430 -5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -2.6280 -6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -1.6860 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -2.2000 -9.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -3.1940 -9.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -5.3460 -10.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -6.9390 -12.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -6.7020 -13.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -4.8610 -12.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -3.2620 -10.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 -1.2130 -1.9390 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4280 -3.5930 -8.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -4.5440 -7.9180 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 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 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 47 -1 M END