D0RO0T MDL 03130710262D 1 1.00000 0.00000 0 21 22 0 0 0 999 V2000 0.7331 -4.0402 0.0000 N 0 0 0 0 0 0 0 0 0 1.3453 -3.6852 0.0000 C 0 0 0 0 0 0 0 0 0 1.3425 -2.9713 0.0000 C 0 0 0 0 0 0 0 0 0 0.7313 -2.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0.1197 -3.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0.1204 -2.9765 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4919 -2.6222 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1088 -2.9754 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1095 -3.6867 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4932 -4.0449 0.0000 C 0 0 0 0 0 0 0 0 0 1.9547 -2.6151 0.0000 N 0 0 0 0 0 0 0 0 0 2.5693 -2.9673 0.0000 C 0 0 0 0 0 0 0 0 0 3.1816 -2.6111 0.0000 C 0 0 0 0 0 0 0 0 0 2.5717 -3.6756 0.0000 O 0 0 0 0 0 0 0 0 0 3.7962 -2.9633 0.0000 C 0 0 0 0 0 0 0 0 0 4.4085 -2.6071 0.0000 C 0 0 0 0 0 0 0 0 0 5.0231 -2.9592 0.0000 N 0 0 0 0 0 0 0 0 0 5.6353 -2.6031 0.0000 C 0 0 0 0 0 0 0 0 0 6.2499 -2.9552 0.0000 C 0 0 0 0 0 0 0 0 0 5.6330 -1.8947 0.0000 O 0 0 0 0 0 0 0 0 0 6.8622 -2.5990 0.0000 S 0 0 0 0 0 0 0 0 0 9 10 2 0 0 0 5 6 2 0 0 0 3 11 1 0 0 0 1 2 2 0 0 0 11 12 1 0 0 0 5 1 1 0 0 0 12 13 1 0 0 0 2 3 1 0 0 0 12 14 2 0 0 0 13 15 1 0 0 0 3 4 2 0 0 0 15 16 1 0 0 0 4 6 1 0 0 0 16 17 1 0 0 0 5 10 1 0 0 0 17 18 1 0 0 0 6 7 1 0 0 0 18 19 1 0 0 0 7 8 2 0 0 0 18 20 2 0 0 0 8 9 1 0 0 0 19 21 1 0 0 0 M END $$$$