CHEMSTAR-ZINC04125252 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 2.0390 1.3860 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 0.0080 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6880 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 0.0060 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 1.3880 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0880 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.5630 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 4.1830 0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 4.2250 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 5.6920 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 6.0770 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 5.4340 -1.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 3.9700 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 3.4980 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 5.8890 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 6.8300 -3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 7.2810 -4.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 6.7990 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 5.8570 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 5.3980 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 5.3700 -3.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 5.6620 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7620 5.1650 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7560 3.7680 -2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0690 3.4480 -3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6190 3.9280 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 7.2850 -5.1930 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4360 8.1100 -6.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 6.8600 -5.2330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.6610 1.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -2.0470 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -2.7060 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0470 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 1.9230 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -0.5320 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 1.9270 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 6.1130 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 6.0710 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 7.1590 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 5.7440 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 3.5250 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 3.6660 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 2.4280 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 3.7050 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 7.2100 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 8.0130 -4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 4.6640 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 5.1550 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 6.7370 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2800 5.3270 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2720 5.7100 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 2.3690 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5600 3.9430 -4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 3.7370 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 3.3930 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -2.5250 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -2.1440 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.6030 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -3.7620 0.9560 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END