IFLAB-ZINC04167101 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -2.5140 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -3.8590 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -4.3860 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -5.7500 3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -6.6050 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -6.0720 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -4.7060 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -8.0670 2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -8.5300 3.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -8.8910 2.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -10.3420 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -11.0400 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -12.5330 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -13.3370 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -14.9950 1.4170 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -14.4220 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -13.1270 1.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -15.2750 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -16.6580 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -17.4500 1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -16.8740 2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -15.4990 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -14.7000 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -17.6580 2.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -17.0000 2.2380 C 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -3.7240 4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -6.1580 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -6.7290 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -4.2940 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -8.5220 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -10.6210 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -10.6470 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -10.7610 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -10.7350 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -13.0230 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -17.1070 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 -18.5200 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -15.0540 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -13.6320 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 -17.7390 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0310 -16.4690 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8850 -16.2900 3.0650 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 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 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 42 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 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END