B7KOL3 -OEChem-04022115373D 58 61 0 0 0 0 0 0 0999 V2000 -6.6763 -3.2650 -0.9975 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.7334 -2.6887 -0.5934 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.3850 -3.1494 1.0489 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9432 -1.5016 2.2597 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5069 -0.6792 0.0351 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5248 1.3972 -1.2785 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4222 0.2409 1.5723 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0922 1.2786 -0.8103 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0636 2.6226 -0.1115 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0445 -1.9555 -1.1254 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5334 2.1951 0.3263 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8951 0.6495 0.2378 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2873 1.2849 0.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9849 -0.8591 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2193 2.2296 -0.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6961 0.7799 -0.7537 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5964 2.5992 -0.3514 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.9240 1.1045 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1474 0.5949 1.3648 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8955 -1.5468 1.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2651 -1.2294 -0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2281 2.1642 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2246 2.6814 0.6485 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1259 -1.1062 -1.1006 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2350 -1.8802 -1.8018 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 0.9947 0.8216 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4009 0.6181 0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7725 -0.7254 0.3202 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3109 1.6082 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0539 -1.0790 -0.1024 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5923 1.2547 -0.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9639 -0.0889 -0.4734 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4512 -2.5153 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4234 0.7804 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2123 2.3498 0.5572 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7843 1.2250 -0.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3697 -1.0511 -1.0209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -1.3368 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0975 2.5308 -1.9698 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4218 0.1086 -1.5737 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3782 0.3216 0.1929 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6033 2.7739 0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 3.4537 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1296 1.0819 1.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6987 0.7537 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4117 -1.5076 1.9974 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9751 -2.6144 0.7695 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1927 3.2556 0.6746 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4015 -1.2933 3.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9325 2.3502 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2489 3.7746 0.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1457 -0.7837 -1.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3848 -2.3814 -2.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0632 2.7314 -0.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -1.5052 0.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0724 2.6662 0.0558 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3033 2.0257 -0.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9671 -0.3427 -0.8041 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 2 33 1 0 0 0 0 3 33 1 0 0 0 0 4 18 1 0 0 0 0 4 49 1 0 0 0 0 5 21 1 0 0 0 0 5 24 1 0 0 0 0 6 22 2 0 0 0 0 7 26 2 0 0 0 0 8 12 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 15 1 0 0 0 0 9 22 1 0 0 0 0 9 48 1 0 0 0 0 10 21 2 0 0 0 0 10 25 1 0 0 0 0 11 23 1 0 0 0 0 11 26 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 13 19 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 20 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 22 23 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 55 1 0 0 0 0 29 31 2 0 0 0 0 29 56 1 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 M END $$$$