IFLAB-ZINC00629593 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 0 0 0 0 0 0999 V2000 0.0250 1.3560 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.1480 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -0.8370 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -2.2400 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.9030 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -2.2250 0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.8560 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -0.4530 0.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -1.5260 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6410 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -1.5000 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 -0.2840 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8040 -0.2620 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -1.4520 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 -2.6660 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -2.6920 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9140 -1.4280 0.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7560 -2.3460 -0.9680 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2510 -3.6700 -0.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1280 -2.0200 -0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3100 -1.7830 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2960 -2.4350 -3.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9280 -2.0250 -4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5770 -0.9280 -5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 -0.4760 -6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8760 0.5890 -6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8900 1.2410 -6.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 0.8310 -4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6080 -0.2650 -4.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9650 -0.7210 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.7160 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.7700 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.6710 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.3090 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -2.7890 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -3.9820 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -3.6630 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 0.6420 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3290 0.6800 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4020 -3.5900 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -3.6360 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3910 -0.8730 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7950 -3.2780 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1400 -2.5400 -5.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4400 -0.9720 -6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6030 0.9340 -7.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3910 2.0840 -6.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0450 1.3470 -4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7520 -0.2280 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 35 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 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 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 17 1 0 0 0 0 15 16 1 0 0 0 0 15 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 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 M END