D0UJ9J OpenBabel06211915323D 31 32 0 0 0 0 0 0 0 0999 V2000 0.9304 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1629 -1.2465 0.4313 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8593 -2.3864 0.8258 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2995 -2.3864 0.8258 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0196 -1.2077 0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3232 -0.0678 0.0235 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1493 -3.5485 1.2279 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2707 -3.5485 1.2279 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4896 -1.2077 0.4179 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3696 -2.6481 0.9163 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9323 -3.0618 2.6233 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9999 -3.8152 -0.0021 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8743 -2.3838 0.8249 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0367 0.1023 4.4366 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6888 -0.2268 5.7948 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0887 -1.5010 6.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8366 -2.4460 5.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1845 -2.1168 3.6805 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7336 -1.8370 7.4822 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4269 0.7835 -0.2711 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8155 -3.2310 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6274 -4.5019 1.5578 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6274 -3.3576 0.2373 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6274 -2.7862 1.8886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9818 -0.4020 0.1391 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4673 0.9604 4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8695 0.4503 6.5523 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4066 -3.3590 5.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6145 -1.2038 3.4647 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -1.1910 8.2049 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3234 -2.7079 7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 1 1 0 0 0 0 7 8 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 11 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 M END $$$$