IBS-ZINC06664568 MOE2007 3D Structure written by MMmdl. 49 52 0 0 0 0 0 0 0 0999 V2000 -4.4670 -3.1210 5.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -3.4420 5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -3.9820 7.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -4.0550 7.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -3.6960 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -3.3180 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -2.8610 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.8030 3.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -3.2140 4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -3.6470 5.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -2.3550 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -0.8510 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -0.3440 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 1.0940 0.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 2.1110 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 3.2950 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 1.6460 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -4.4130 8.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -5.1180 8.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -5.4300 9.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -5.0160 10.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -4.3210 10.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -4.0330 9.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -4.4840 8.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -3.8140 4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -3.1860 6.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -2.0960 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -3.1310 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -2.6210 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -2.8950 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -0.6070 3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.3250 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -0.5320 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -0.8540 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.8510 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 4.3320 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 1.1170 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -5.4640 7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -5.9870 9.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -5.2350 11.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -3.4280 9.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -5.3100 8.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -3.6750 8.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5330 -4.8750 7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -2.6320 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 2.9720 1.1850 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0370 3.6390 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -2.5400 3.0280 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4450 -2.2170 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 48 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 46 1 0 0 0 0 17 37 1 0 0 0 0 17 46 2 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 45 48 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 46 1 M CHG 1 48 1 M END