IBS-ZINC02196036 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -4.8120 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -5.1450 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -5.7150 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -5.8450 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -5.2310 -1.5090 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.2570 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 1.3090 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 1.5690 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 2.3720 -2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4770 1.8880 -2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3790 2.9160 -2.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3420 2.8130 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 4.1180 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3430 3.8300 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4190 4.8680 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8570 6.1610 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2130 6.4500 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1410 5.4410 -2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -2.4290 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -4.9820 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -6.0310 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -6.2660 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -0.3050 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 1.2010 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 2.2600 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 0.7540 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 2.1230 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 0.6180 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7300 0.8410 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 4.6510 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 6.9640 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5430 7.4770 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1940 5.6760 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 0.5260 -1.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 0.9900 -1.8500 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 51 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 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 M END