IBS-ZINC02103337 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 1.3530 0.5580 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.9120 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -1.2560 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.7370 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -3.0790 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -4.5810 -0.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8550 -5.1350 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -4.9390 -0.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5660 -4.4980 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 -6.4650 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -4.3760 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -4.7320 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 -3.9840 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -3.3020 -4.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9130 -4.2090 -3.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7930 -3.6910 -4.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1390 -4.0670 -4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0750 -3.5970 -5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6900 -2.7390 -6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3410 -2.3670 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4010 -2.8360 -5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7020 -2.2310 -7.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9050 -2.6160 -7.1380 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0600 -5.0040 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -4.4980 2.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.7820 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 0.8180 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 1.1980 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -1.5240 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -1.1450 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -0.6400 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -1.0150 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -3.3530 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -2.9680 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -2.4900 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -2.7540 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -6.8840 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 -6.7370 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -6.9620 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -3.2830 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -4.7240 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 -5.8030 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 -4.4950 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3340 -4.8150 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4830 -4.7300 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1170 -3.9020 -5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0150 -1.7000 -7.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 -2.5120 -5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2750 -1.4570 -8.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -5.8140 1.2090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 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 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 50 -1 M END