IFLAB-ZINC05241395 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -0.6050 1.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -0.2900 1.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.3250 2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -2.3600 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -3.0310 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -4.4090 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -5.1240 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -4.4540 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -3.0640 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -5.2140 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -4.6280 2.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -6.5560 2.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -7.2690 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -8.6270 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -9.1190 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -8.1290 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -6.5710 3.6440 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 -8.3400 4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 -9.7380 4.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -10.7820 4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 -10.5870 3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -10.0520 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -11.2100 4.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5690 -8.9630 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -9.4830 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -10.1620 1.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -2.4760 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -4.9260 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -6.2000 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -2.5400 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -7.0240 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -8.1510 5.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6060 -7.6690 4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 -10.7040 5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6850 -11.7640 4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -10.8930 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -11.1880 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6250 -8.6120 3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5400 -9.3550 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2920 -8.1340 4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 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 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 3 0 0 0 0 M END