OTAVA-ZINC01784725 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.0560 1.5090 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.0210 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.5440 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.0740 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -2.5700 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -3.9030 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -4.6300 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 -4.4920 0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8010 -4.1680 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -4.0170 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -5.9540 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -6.5820 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -7.8740 -1.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -8.6890 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -8.1390 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -6.6670 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -6.1130 1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -9.1030 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -10.3760 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -10.4430 0.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -11.5460 2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -11.3990 3.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 -12.7840 1.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -13.8920 2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -13.7420 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 -14.8380 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 -16.0850 4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -16.2390 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -15.1450 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 -15.3120 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -17.2800 5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -8.7400 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 1.8820 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 1.8750 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 1.8610 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.3720 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.3860 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.1920 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.1780 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -2.4250 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.4400 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 -4.3410 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 -4.4430 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -2.9290 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -5.9840 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -12.9070 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -12.7680 4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -14.7220 5.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -17.2140 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -15.5350 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -16.1310 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -14.3910 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -17.3880 5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 -18.1770 4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -17.1380 6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8780 -8.7040 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6120 -9.4910 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -7.7650 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 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 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END