BUTH58 -OEChem-04012114213D 29 29 0 0 0 0 0 0 0999 V2000 -2.4694 -1.7088 -0.4738 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6064 0.3377 -0.6505 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0459 0.8864 0.2232 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2414 0.6428 -0.6728 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6636 0.5269 0.5543 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6624 0.2541 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5517 1.2245 0.0856 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0567 -1.0675 -0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3551 2.3003 0.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0026 -0.0268 -0.2624 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8661 0.8650 0.3835 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3711 -1.4270 -0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2757 -0.4606 0.2414 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8823 -2.3471 1.1675 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 1.6685 -1.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1302 0.0198 -1.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3129 1.1932 1.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6139 -0.4803 0.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2415 2.2591 0.2015 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3589 -1.8275 -0.8366 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3399 2.5990 0.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6085 2.9149 -0.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3046 2.4945 1.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5704 1.6172 0.7268 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6901 -2.4593 -0.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 -0.7406 0.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -3.3809 1.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9642 -2.3317 1.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3997 -1.7569 1.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 10 2 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 11 1 0 0 0 0 7 19 1 0 0 0 0 8 12 2 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 11 13 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 M END $$$$