D06DBA -OEChem-10101305022D 46 48 0 0 0 0 0 0 0999 V2000 8.1962 2.3860 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 2.3927 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 4.6660 -0.6382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 3.3618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0602 2.8893 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.6995 1.5219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6928 3.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8552 -2.7127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 -0.6728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 3.3964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 2.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 1.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.3618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.3618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 0.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2746 -1.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2631 -2.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1464 -0.6928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1232 -2.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0066 -1.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9950 -2.2027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8436 -3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 0.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -0.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 3.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 3.7002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 3.7126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.1947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7226 -2.4864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1535 -0.0728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1161 -3.3126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5470 -0.8990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2237 -3.7054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8364 -4.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4636 -3.7198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 15 1 0 0 0 0 3 18 2 0 0 0 0 4 19 2 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 13 1 0 0 0 0 9 23 1 0 0 0 0 9 33 1 0 0 0 0 10 14 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 13 20 2 0 0 0 0 14 15 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 2 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 20 32 1 0 0 0 0 21 24 1 0 0 0 0 21 34 1 0 0 0 0 22 25 1 0 0 0 0 22 35 1 0 0 0 0 23 26 2 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 28 1 0 0 0 0 26 40 1 0 0 0 0 27 29 2 0 0 0 0 27 41 1 0 0 0 0 28 30 2 0 0 0 0 28 42 1 0 0 0 0 29 30 1 0 0 0 0 29 43 1 0 0 0 0 31 44 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 M CHG 2 2 1 5 -1 M END $$$$