IBS-ZINC02316035 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 1.0890 1.5170 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 0.0290 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -0.8240 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -2.2110 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.7720 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -1.9170 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.5290 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -4.1920 -0.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -4.9730 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -6.2980 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -6.2270 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -4.9780 0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -7.3040 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -6.8950 -2.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -5.5830 -2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -4.5600 -2.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -8.6620 -1.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -9.8180 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -11.0350 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -12.2040 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -12.1600 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -10.9740 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -9.8110 -3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -13.6590 -3.4610 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -13.4950 -4.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -14.7120 -2.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6710 -13.6240 -2.9250 N 0 5 0 0 0 0 0 0 0 0 0 0 -5.1040 -12.8340 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 1.7970 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 2.0120 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 1.8900 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -0.4160 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -2.8390 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -2.2840 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 0.1160 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -7.0360 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -5.3250 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -8.8500 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -11.0820 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -13.1320 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -10.9480 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -8.9020 -3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 37 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 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 27 -1 M END