B35IQR -OEChem-04022106353D 40 42 0 0 0 0 0 0 0999 V2000 -1.6551 -0.7419 -0.6877 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1041 -2.7572 0.2729 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1551 2.5742 -0.9857 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5685 -0.3069 0.2444 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0242 -0.5062 -0.3334 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4296 0.7321 -0.0578 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 0.9496 -0.0981 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 0.3208 0.5102 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2476 3.4667 -0.8414 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -0.1187 -0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8795 -0.0019 -1.2147 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -0.9549 0.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9662 -1.0783 -0.8057 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9014 -0.7203 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9104 1.1153 -0.3687 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9973 -1.8686 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4592 -1.7811 -0.1039 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1528 -2.4075 -0.5048 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8743 -2.9207 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1984 -0.5804 2.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3697 2.3816 -0.7502 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8862 1.8347 0.5332 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7364 2.1680 1.5594 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7583 1.2018 1.4975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3744 0.7389 -1.8446 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7349 -0.3912 -1.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3853 -2.0102 0.4203 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0127 -1.7642 0.2595 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5984 -0.1170 -0.0193 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3908 0.2351 -0.6247 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -2.9418 -0.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -3.9325 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0941 0.4598 2.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2206 -0.9060 2.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -1.1885 2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9636 2.2788 0.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6303 2.9905 2.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6280 1.1029 2.1309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 4.3883 -1.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2406 3.3733 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 17 2 0 0 0 0 3 21 2 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 5 30 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 22 1 0 0 0 0 7 15 2 0 0 0 0 8 24 2 0 0 0 0 9 21 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 13 18 2 0 0 0 0 14 20 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$