D0Z6IB -OEChem-04152112553D 45 48 0 1 0 0 0 0 0999 V2000 -4.1080 -0.2235 -0.7753 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2425 1.7940 -0.4244 N 0 0 2 0 0 0 0 0 0 0 0 0 0.8251 -0.7101 -0.7160 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9607 -0.6000 0.3375 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0991 0.8856 0.7391 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2380 0.1277 -1.9691 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.2049 -1.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7713 -1.5501 1.5388 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4791 -0.0924 -0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8456 1.3402 1.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3953 1.1043 -1.7033 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4825 -3.1393 0.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6102 -2.9976 1.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4463 0.8846 0.8614 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7308 -0.4344 -0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3079 2.7723 -0.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 1.4423 1.3392 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9129 0.1346 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 1.0680 0.7975 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2763 0.3989 -0.2437 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9052 -0.9156 -0.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 0.9793 1.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3823 0.6908 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5546 -0.5330 -2.7865 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6143 -2.5189 -1.6292 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1073 -2.3611 -1.8545 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -1.4737 2.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8937 -1.2818 2.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8781 0.9428 2.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8405 2.4341 1.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4141 1.8329 -2.5236 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 0.5679 -1.7468 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4417 -4.1760 -0.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4798 -2.9321 0.5522 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4096 -3.6365 1.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5499 -3.3490 0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8045 -1.1437 -1.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2934 2.2971 -0.1558 H 1 0 0 0 0 0 0 0 0 0 0 0 3.3280 3.4994 -1.0386 H 1 0 0 0 0 0 0 0 0 0 0 0 3.1384 3.3429 0.7006 H 1 0 0 0 0 0 0 0 0 0 0 0 -1.6227 2.1787 2.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7479 1.5465 1.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1343 -0.0010 -0.7940 H 1 0 0 0 0 0 0 0 0 0 0 0 -5.2669 1.4815 -0.4096 H 1 0 0 0 0 0 0 0 0 0 0 0 -5.4251 0.1417 0.8105 H 1 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 20 1 0 0 0 0 2 5 1 0 0 0 0 2 11 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 21 1 0 0 0 0 5 10 1 0 0 0 0 5 22 1 0 0 0 0 6 11 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 12 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 13 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 19 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 M ISO 6 38 2 39 2 40 2 43 2 44 2 45 2 M END $$$$