76 OpenBabel04211813443D 49 52 0 0 0 0 0 0 0 0999 V2000 10.5231 2.6916 -0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9839 -2.8864 0.4623 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1269 -0.1532 0.1958 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1992 -0.8620 -0.4479 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6276 -0.1711 -0.1717 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5596 1.4130 -0.0403 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7282 -0.8086 -0.0791 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1469 1.3520 -0.5386 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6341 1.9432 -1.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4408 -0.3696 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2869 -2.3367 0.0285 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7537 -2.2939 0.2855 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6251 -0.0851 0.7547 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9775 1.6865 0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6889 0.5655 0.7427 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9096 -2.9802 0.2781 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0592 2.0164 1.3541 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4193 -0.6757 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4396 -3.0384 0.6323 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2241 -0.8122 0.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 -2.2221 0.1555 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3653 -0.1528 1.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9445 -0.7747 -1.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2436 -0.5357 -1.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 1.2953 -1.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7279 2.0675 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6406 3.0331 -1.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8845 1.5828 -2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9086 -0.0157 1.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7343 -1.4094 1.2564 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8061 -2.9163 -0.7348 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8559 -2.3665 0.9577 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9913 0.0185 1.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4717 0.9032 0.3211 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1998 0.9274 1.6349 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4019 0.0509 0.0986 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8701 -4.0543 0.4591 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0629 3.1051 1.3017 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7257 1.6893 2.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0476 1.6664 1.5598 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4503 -1.1244 -1.8575 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1938 -1.1896 -2.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4024 0.3779 -1.9181 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4378 -4.0105 0.1392 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3809 -3.1778 1.7117 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9385 -0.9201 1.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4935 -0.1874 0.2989 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2814 -2.1156 -0.9291 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -2.3461 0.1257 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 21 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 22 1 1 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 23 1 6 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 24 1 6 0 0 0 6 9 1 0 0 0 0 6 14 1 0 0 0 0 6 17 1 1 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 18 1 6 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 15 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 16 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 16 2 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 21 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 6 0 0 0 M END