B8T3PA -OEChem-04012119142D 40 43 0 0 0 0 0 0 0999 V2000 2.7357 1.8964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4793 -0.4680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2395 0.8741 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6966 1.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0731 2.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4741 1.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0731 2.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4496 1.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5731 0.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6721 1.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3436 0.4299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2738 -0.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4591 2.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3353 -1.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 0.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6901 1.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9219 0.5825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1796 -1.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2376 -2.1420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1069 -2.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1293 -2.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2552 1.7092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0832 2.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6317 3.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9351 3.3645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2111 3.3645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5145 3.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3281 2.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0645 -0.3197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 0.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 -0.9313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7558 0.5308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2787 1.4929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6759 -2.4045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6205 -2.6366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0806 -3.3781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 1.6752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5439 0.7991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.7630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 22 1 0 0 0 0 2 9 2 0 0 0 0 2 14 1 0 0 0 0 3 11 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 9 1 0 0 0 0 6 11 2 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 10 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 14 1 0 0 0 0 12 18 2 0 0 0 0 13 16 2 0 0 0 0 13 29 1 0 0 0 0 14 19 2 0 0 0 0 15 17 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 31 1 0 0 0 0 18 20 1 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$