IBS-ZINC01755023 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 4.0260 -0.8860 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.8820 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -1.9010 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.8520 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -3.7930 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -3.7990 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -2.8470 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -4.7920 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -5.1890 0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.2250 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -6.5050 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -6.5210 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -7.5530 -3.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -5.2080 -3.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -4.2740 -2.5950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8720 -3.7150 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -3.3200 -2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -1.9340 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -1.0260 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -1.5020 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -2.8770 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -3.7770 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 -0.5490 -2.1280 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2100 0.6610 -2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -1.0010 -1.9300 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1010 -4.8000 -5.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -4.8400 -5.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -4.5740 -7.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -4.6540 -8.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -4.5070 -7.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -7.6390 -1.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -1.2930 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -0.6430 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 0.0500 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -1.1770 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -2.8550 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -4.5470 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.8690 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -1.5450 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 0.0400 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -3.2670 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -4.8450 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -3.8000 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -5.4940 -5.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -5.8160 -5.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -4.0940 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -3.5740 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -5.2970 -7.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -8.3790 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -4.8470 -9.2550 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 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 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 31 49 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 50 -1 M END