SIAL-ZINC04533758 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 61 0 0 1 0 0 0 0 0999 V2000 -0.4150 1.7320 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 0.2050 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.3010 -0.3720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3580 -0.0060 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -1.8290 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -2.3320 0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -2.5460 -1.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -4.0110 -1.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3420 -4.4490 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -4.4690 -1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -3.8770 -3.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -4.3830 -3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.3940 -2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -3.5270 -2.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -5.7360 -2.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -6.1280 -3.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5050 -5.4960 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -7.6060 -3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -7.8800 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -9.3170 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -9.5340 -2.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -10.6770 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -11.7580 -2.7110 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5460 -11.7400 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -12.6080 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -5.8120 -4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -5.0980 -4.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.1250 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 3.5840 -0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 4.1810 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 3.4540 -0.7620 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5210 2.4440 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 3.8960 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 2.1260 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 2.2040 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.2490 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.1490 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -2.1050 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -5.5570 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -4.1690 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -6.4450 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -8.2360 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -7.9230 -4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -7.1870 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -7.6970 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -10.0250 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -9.5060 -3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -8.7690 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 1.7030 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 1.7380 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 4.1950 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 -10.7450 -1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -9.9600 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -11.5840 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -6.2930 -5.9960 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9440 0.3340 0.6100 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8860 -0.0660 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 1.3530 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 0.0900 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 5.5270 -0.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 6.1210 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 5.9950 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 56 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 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 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 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 56 59 1 0 0 0 0 60 61 1 0 0 0 0 60 62 1 0 0 0 0 M CHG 1 23 1 M CHG 1 31 1 M CHG 1 55 -1 M CHG 1 56 1 M END