SIAL-ZINC04534031 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.5250 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0050 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.5670 1.2460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0350 -1.6020 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -0.5100 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -0.5880 2.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1690 0.2060 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -0.6990 0.3000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -1.9310 2.8410 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3420 -1.9400 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -1.6170 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -2.1730 3.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -3.0810 1.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -4.2060 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -4.2670 3.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -5.3900 1.4870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6130 -5.7240 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -4.9900 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -4.6840 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -4.3170 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -4.2560 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 -4.5630 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -4.9340 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -6.4780 2.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -7.7550 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -7.9970 0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -8.7630 2.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -8.6050 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -10.0530 4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -10.8730 3.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -10.0680 2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -10.4840 1.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 0.2560 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 1.1080 2.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -0.5420 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 1.9020 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8860 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.8760 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -3.0330 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -4.7310 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -4.0780 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -3.9690 -2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6630 -4.5150 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -5.1770 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -6.2800 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -8.0700 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 -8.0860 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -10.2370 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8320 -10.2530 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -11.8420 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -0.1900 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.6320 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.1860 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 0.0420 0.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 0.5940 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 33 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 35 51 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 54 55 1 0 0 0 0 M END