IBS-ZINC02226167 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 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 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -2.1040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.6100 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -2.8820 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -4.3410 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.8490 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -5.2810 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -5.7680 3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -6.2270 4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -6.6760 5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -6.6800 6.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -6.2330 5.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -5.7720 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -5.3190 3.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -5.3220 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -4.8790 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.4900 1.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -2.2700 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -2.0500 -1.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3260 -1.4750 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -1.3260 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 -1.9740 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -3.0130 -3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 -3.3170 -2.0610 O 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 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -4.7820 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -4.6180 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -5.2660 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -6.2260 3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -7.0290 5.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 -7.0380 7.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -6.2400 5.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -2.9300 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -1.3130 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -1.4980 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -0.2590 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 -2.4670 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -1.2270 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -3.9100 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -2.5870 -3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END