IFLAB-ZINC02817045 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.2880 1.0610 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.4290 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -1.2990 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -2.6620 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -3.0890 0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -2.2300 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.9210 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.7110 -2.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -4.2860 -2.4320 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -4.4570 -3.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -5.0790 -1.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -4.4720 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -4.2460 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -4.3910 -2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -4.7640 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -4.9900 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -4.8480 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 -4.9110 -0.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -4.6120 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 -4.1260 1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7080 -4.8740 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0750 -4.5640 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3610 -4.8080 2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2970 -5.3660 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9280 -5.6750 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6440 -5.4260 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6730 -5.6280 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0210 -5.2690 3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6460 -6.3420 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 1.3880 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 1.5680 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 1.3040 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -0.9240 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -3.3670 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.1260 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.9560 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 -4.2140 -3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -5.2800 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -5.0270 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 -5.2280 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -4.1340 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6450 -4.5690 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6510 -6.1060 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3590 -5.6610 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1860 -6.5040 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9130 -7.3020 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5440 -5.7350 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M END