B2KP0J -OEChem-04012119302D 44 47 0 1 0 0 0 0 0999 V2000 8.9030 0.6016 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 0.5210 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6783 -2.7833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.2233 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6783 -1.1738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 1.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3426 0.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 0.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -0.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 1.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 2.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -0.5551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 0.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 2.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2746 3.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 3.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1815 0.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.9785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -3.3726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2147 0.9215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7359 0.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4704 -0.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 1.3949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -1.3507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0243 1.2163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3572 2.0880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 1.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 -1.0166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5276 2.7561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8605 3.6278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4457 3.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 15 2 0 0 0 0 9 27 1 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 16 1 0 0 0 0 12 32 1 0 0 0 0 13 20 1 0 0 0 0 13 33 1 0 0 0 0 14 21 2 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 35 1 0 0 0 0 16 19 2 0 0 0 0 16 36 1 0 0 0 0 17 23 1 0 0 0 0 17 37 1 0 0 0 0 18 24 2 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$