D0M0IQ -OEChem-10101305022D 42 45 0 0 0 0 0 0 0999 V2000 3.2508 -2.6760 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6978 2.5862 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3788 -0.0024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9259 -5.7638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.5947 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9721 -0.9159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 0.8066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1978 1.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5598 -1.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3669 3.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -3.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5598 -1.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1759 1.9281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8689 -2.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2804 2.9226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 4.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -4.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 4.9766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1938 -4.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 4.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9259 -4.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1938 -5.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 5.9548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 6.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -6.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 1.1533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3603 0.3606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4581 -0.5692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5414 -1.3619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9954 0.0624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6367 1.5132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9243 -1.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8174 3.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4585 -2.8676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4918 4.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6569 -4.4538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7472 4.2016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4628 -4.4538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6569 -6.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 6.3696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6142 6.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -6.8838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 30 1 0 0 0 0 4 21 1 0 0 0 0 4 25 2 0 0 0 0 5 20 1 0 0 0 0 5 24 2 0 0 0 0 6 9 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 13 2 0 0 0 0 9 12 2 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 14 2 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 14 34 1 0 0 0 0 15 33 1 0 0 0 0 16 18 1 0 0 0 0 16 20 2 0 0 0 0 17 19 1 0 0 0 0 17 21 2 0 0 0 0 18 23 2 0 0 0 0 18 35 1 0 0 0 0 19 22 2 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 25 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$