IBS-ZINC00001558 MOE2007 3D Structure written by MMmdl. 36 38 0 0 0 0 0 0 0 0999 V2000 0.8820 -3.0780 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -1.8200 1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -2.0630 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -1.3990 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -0.0790 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 0.0360 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 2.1010 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 1.2080 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 1.7050 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 0.9120 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 1.5160 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 2.9040 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 3.7070 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 3.1190 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 3.4930 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 4.4200 -0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -3.9170 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -3.3770 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.9040 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -1.0200 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -1.1470 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -2.3960 3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -2.8310 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -1.3810 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -2.1310 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -0.7820 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -0.1690 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 0.8970 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 3.3580 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 4.7870 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 5.4210 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 4.1260 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 1.3310 -0.1320 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3770 1.6780 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 3.9020 0.0310 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7230 4.9110 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 26 1 0 0 0 0 6 33 2 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 35 2 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 33 1 M CHG 1 35 1 M END