CHEMBRIDGE-ZINC02868819 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.1150 1.6240 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 0.1000 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.4850 -1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -1.3360 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -1.6510 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -0.9390 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.2720 -2.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -0.9480 -4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.6130 -5.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -0.2180 -5.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.3020 -6.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -1.5040 -7.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -1.5830 -8.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.4670 -9.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 0.7320 -8.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.8160 -7.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -2.5000 -2.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -3.5100 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -3.7030 -0.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 -4.3670 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 -5.3770 -1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 -5.5140 -0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 -6.3170 -2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -7.3640 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 -8.2430 -1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9990 -8.0840 -3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 -7.0450 -3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 -6.1650 -3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 -6.8940 -5.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -7.8410 -5.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -9.2620 -0.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8560 -10.1310 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 1.9920 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.9060 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 2.0590 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.1830 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.2690 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -1.6950 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 0.3640 -4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -2.3760 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.5170 -9.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.5310 -10.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.6020 -9.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 1.7510 -7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.3600 -3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -4.2580 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 -7.4870 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -8.7710 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -5.3590 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 -7.7950 -4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7090 -8.8440 -5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 -7.6070 -6.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 -10.6030 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7540 -9.5540 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 -10.8990 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 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 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 31 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 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END