PUBCHEM-ZINC03873147 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.7760 -0.5160 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -1.6690 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.1210 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -1.4220 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.2630 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 0.1870 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -1.9020 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -1.1090 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -1.6570 0.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7710 -1.7200 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -0.6410 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -0.8540 -1.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -3.7980 0.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5960 -3.1700 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -4.6120 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 -3.7510 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6450 -4.6170 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8690 -3.7530 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -4.8360 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -5.6210 0.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -4.9150 2.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -3.9110 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 -4.2470 4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -5.7690 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -6.1180 3.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6300 -6.2830 2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 -7.4130 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -7.2530 2.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -0.1610 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -2.2170 -3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -3.0200 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 0.2990 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.0880 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -1.8080 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.9730 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -1.1180 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -0.0540 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5910 -5.3940 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 -5.1380 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 -3.0710 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7600 -3.1360 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8630 -5.3610 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3850 -5.1700 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7200 -3.0300 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1830 -3.2320 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 -4.0340 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -2.8990 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -3.8570 5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -3.8340 4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 -6.1830 5.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -6.1500 5.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3010 0.2600 0.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4010 -2.9750 -0.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -2.7240 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9940 -4.6260 -1.5140 N 0 3 0 0 0 0 0 0 0 0 0 0 12.8680 -4.0900 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8270 -5.0560 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1370 -5.3830 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -8.4910 3.3240 O 0 5 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 53 1 0 0 0 0 11 12 2 0 0 0 0 11 52 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 13 53 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 52 -1 M CHG 1 55 1 M CHG 1 59 -1 M END