B4KU7Z -OEChem-04012115512D 40 41 0 1 0 0 0 0 0999 V2000 2.0000 -3.7938 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 0.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9954 3.1721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4131 2.4676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -0.2060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.7451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5942 4.1902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 1.5541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0009 3.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1874 5.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5077 4.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6806 3.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9506 1.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2505 1.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3338 1.9008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 -0.7429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1075 0.0462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7965 2.5325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7538 5.3559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9352 5.6701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 4.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7599 4.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0741 4.8491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2555 5.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4284 4.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1142 3.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9328 3.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.1038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 11 2 0 0 0 0 4 21 1 0 0 0 0 4 40 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 27 1 0 0 0 0 6 12 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 22 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 12 16 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 20 2 0 0 0 0 18 38 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 M END $$$$