IBS-ZINC00102318 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 3.7580 1.4280 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 1.1990 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.6930 3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 3.1490 3.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 3.9020 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 3.4330 2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 3.6940 4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 3.0440 5.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 5.1550 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 5.8080 3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 7.1930 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 7.9250 4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 7.2620 5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 5.8790 5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 5.2210 6.5990 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0460 5.4410 7.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 4.5220 6.1640 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7510 9.2770 4.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 10.0560 5.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 7.9250 2.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 7.2200 1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 0.3530 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 1.6430 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 1.9440 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 1.4080 4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 0.1280 3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.4390 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.1940 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 3.7330 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 4.9760 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 3.8890 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 3.6620 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 5.2190 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 7.7990 6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 11.0970 5.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 9.7490 6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 10.0110 5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 6.7020 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 6.5240 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 7.9530 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 1.9230 2.7360 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0540 1.7060 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 41 1 M END