IBS-ZINC05573721 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.5600 0.7080 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.3970 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -0.6360 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -1.2260 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.2000 0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -3.0360 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -2.9170 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -3.7610 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -4.7380 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -4.8570 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -4.0000 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 -5.8060 -1.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -5.6470 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7320 -5.1390 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7900 -6.0360 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 -7.3290 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 -7.7720 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -6.9610 -0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -3.8060 0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2260 -3.3880 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 -3.5390 1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0970 -3.1150 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8240 -2.5390 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2540 -2.3860 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9520 -2.8070 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9690 -1.8200 -1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3030 -1.4060 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 1.1920 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 1.4400 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 0.2900 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -1.4280 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.0420 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -1.7300 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.5790 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -2.1610 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -3.6670 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -4.0860 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -5.5100 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -5.6850 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -8.8330 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2350 -3.9890 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5420 -3.2330 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8370 -2.2090 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5050 -2.6850 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7600 -0.9720 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8860 -2.2680 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2790 -0.6620 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 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 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END