B0P4NS -OEChem-04012113512D 42 45 0 0 0 0 0 0 0999 V2000 8.1301 2.1344 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 4.1344 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.1344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.6344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.3656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.8656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6147 -3.5680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6366 -3.3601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.9002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4456 -1.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1147 -2.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 3.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 4.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1093 -2.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6101 0.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0087 1.2421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.7890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -2.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.6985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.9673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 2.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5745 -1.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 3.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8669 -4.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 4.7544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1741 -3.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7259 -2.5327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0444 -1.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 24 1 0 0 0 0 3 13 2 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 12 2 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 38 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 15 2 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 18 1 0 0 0 0 15 30 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 25 1 0 0 0 0 21 24 2 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 27 1 0 0 0 0 24 26 1 0 0 0 0 25 26 2 0 0 0 0 25 37 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M END $$$$