BACHEM-ZINC04899590 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.4950 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0120 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.6290 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.6730 -1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.1380 -1.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0120 -2.4900 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -2.6410 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -2.2200 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -1.0100 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -0.6230 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -1.4470 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -2.6570 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -3.0460 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -2.6620 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -1.9490 0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -3.9230 -0.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -4.4330 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -5.8580 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -6.3950 -1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -6.5350 0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -7.8240 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -8.6840 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -9.9540 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -10.3700 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -9.5170 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -8.2470 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 -11.7330 -1.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3900 -12.4860 -2.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -12.1010 -1.7930 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0210 1.8700 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8620 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.8430 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.1790 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.2170 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -3.7280 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -0.3660 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 0.3230 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 -1.1450 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -3.3010 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -3.9930 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -4.4940 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -4.3960 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -3.8190 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -6.1300 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -8.3590 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -10.6230 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 -9.8440 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 -7.5820 -0.1120 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 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 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END