D01WAI -OEChem-04152109573D 29 31 0 0 0 0 0 0 0999 V2000 -4.3371 -0.4058 0.2466 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -2.3984 -0.4233 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6075 -1.8395 0.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7314 1.8450 -0.0262 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0717 1.0582 0.1841 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6248 -0.5497 0.0668 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3583 1.6394 0.5483 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1513 -0.3398 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3559 -1.7195 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8412 0.6969 -0.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2256 -2.2602 0.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2125 0.5595 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4679 -0.1363 -0.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1126 -0.5649 0.2181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5691 2.0935 -0.3557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7545 2.7714 -0.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -1.2224 -0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3411 0.7725 0.2755 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9601 -1.6360 -1.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3482 -2.4869 -0.9012 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2403 -3.3551 0.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8586 -1.9743 1.4991 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3017 -2.5650 0.5454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3698 2.5858 -0.5622 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7106 2.0623 0.0955 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9884 3.8251 -0.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5489 -0.9641 0.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1817 2.6253 0.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3208 1.3241 0.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 17 2 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 3 23 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 4 25 1 0 0 0 0 5 13 1 0 0 0 0 5 18 2 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 6 27 1 0 0 0 0 7 18 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 14 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 26 1 0 0 0 0 M END $$$$