B78GRI -OEChem-04022115183D 37 40 0 0 0 0 0 0 0999 V2000 -6.6346 2.2061 0.4839 I 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 -1.4419 1.3157 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8888 0.5236 0.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1143 -0.5987 -0.2111 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1097 -2.9905 -0.2571 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9962 -1.9883 -0.0304 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0587 -1.5720 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2305 -0.4627 -0.3504 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7253 0.9308 -0.3762 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5321 -1.4422 -0.5995 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9266 1.3636 0.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1585 -0.8060 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9045 1.9221 -0.9656 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4374 -2.8130 -0.3931 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2171 2.7407 0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -1.8548 -0.1732 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2279 3.2792 -0.9214 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3799 3.6904 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0358 -1.0469 0.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3095 -1.3528 -0.3938 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7934 0.1916 0.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3405 -0.4203 -0.2794 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8242 1.1241 0.7946 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0978 0.8181 0.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7779 -0.8574 -1.4941 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9946 -2.4264 -0.7444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5055 0.9787 1.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0235 1.6443 -1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -3.7325 -0.4606 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1241 3.0854 0.8014 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 4.0100 -1.3807 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 4.7450 -0.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3082 -2.9480 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5111 -2.3140 -0.8597 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 0.4552 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3253 -0.6790 -0.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6164 2.0798 1.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 12 2 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 27 1 0 0 0 0 4 8 2 0 0 0 0 4 16 1 0 0 0 0 5 14 1 0 0 0 0 5 16 2 0 0 0 0 6 16 1 0 0 0 0 6 19 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 15 2 0 0 0 0 13 17 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 18 1 0 0 0 0 15 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 24 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 M END $$$$