D04JEE -OEChem-04152108442D 40 41 0 1 0 0 0 0 0999 V2000 5.4641 0.7327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7673 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 1.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 3.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 3.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 0.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 0.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -3.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -3.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.7304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.8043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 1.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 3.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 4.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 1.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 3.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 20 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 23 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 15 1 0 0 0 0 12 17 2 0 0 0 0 13 16 1 0 0 0 0 13 34 1 0 0 0 0 14 18 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 M END $$$$