B4PT1O -OEChem-04042102023D 31 32 0 0 0 0 0 0 0999 V2000 4.5658 -0.3833 0.0299 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6619 2.7293 0.9006 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6656 2.5680 -1.2887 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4304 -3.8230 0.2846 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9631 -0.7446 -0.4773 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3387 2.1389 -0.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.8509 1.3237 0.5065 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4176 -0.1420 0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0268 -0.0602 -0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 1.0211 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0449 -1.3844 0.0982 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5756 0.9419 -0.0701 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4375 -1.4637 0.1064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2028 -0.3006 0.0224 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7817 -1.1068 -0.5325 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6646 1.0650 0.5196 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8119 0.0974 -0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1743 -1.0280 -0.5402 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0572 1.1439 0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0702 -2.7720 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2636 0.1796 -0.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7244 2.0019 -0.1834 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4672 -2.2995 0.1987 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3295 -1.9879 -0.9795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1194 1.8893 0.9714 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7408 -1.8526 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4851 2.0422 0.9402 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1721 -2.8036 0.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9669 0.4981 -0.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3601 2.1182 0.8955 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8631 1.4020 0.5188 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 29 1 0 0 0 0 2 6 1 0 0 0 0 3 6 2 0 0 0 0 4 20 2 0 0 0 0 5 21 2 0 0 0 0 6 12 1 0 0 0 0 7 21 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 12 2 0 0 0 0 10 22 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 12 14 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 15 18 1 0 0 0 0 15 24 1 0 0 0 0 16 19 2 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 20 28 1 0 0 0 0 M CHG 2 2 -1 6 1 M END $$$$