BACHEM-ZINC04899589 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.4530 1.7980 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 0.3290 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.0950 -0.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -0.4660 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -1.9230 0.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1720 -2.2570 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -2.6300 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -2.2120 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -2.9510 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -2.4920 -4.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -2.9960 -6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -2.4940 -7.1580 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0600 -1.7460 -7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -2.8500 -8.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -2.2770 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -1.4060 2.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -3.6450 1.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.2810 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -3.6020 3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -4.3000 4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -5.6910 4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -6.3880 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -5.6790 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -6.4270 5.7980 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1110 -5.7740 6.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -7.6650 5.7430 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4710 2.3800 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 2.0430 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 2.0580 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -0.0160 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -2.4580 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -3.7150 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -2.4140 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -1.1350 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -2.7560 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -4.0260 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -1.7480 -4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -4.2650 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -2.5230 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -3.7410 5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -7.4720 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -6.2380 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -3.9920 -6.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -4.3880 -5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -4.3670 -7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 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 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 12 1 M CHG 1 24 1 M CHG 1 26 -1 M END