B5IS3P -OEChem-04012113333D 69 71 0 1 0 0 0 0 0999 V2000 -3.1627 -2.2436 2.1212 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2928 -2.7012 2.8359 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6615 -2.6206 0.4663 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2838 0.5760 -2.7623 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6997 2.4994 -1.4591 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0797 -0.6949 1.7643 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6341 3.6644 -0.2694 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4846 0.0696 -1.5744 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2314 4.0745 2.6244 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0149 0.7039 1.6305 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6727 -3.7400 -0.9988 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2625 -2.2819 0.6512 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -1.0377 -1.4091 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1161 1.8875 0.8184 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6545 2.6541 -0.6944 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3105 -0.5909 -0.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0534 1.8451 1.5707 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9322 -1.5800 0.7857 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3805 -3.7708 -1.7599 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7794 1.7626 -0.4093 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9209 2.3176 -1.2625 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1963 2.8911 -2.4761 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9208 3.4629 -1.8786 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5041 2.8497 0.0561 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4285 0.3387 -0.8351 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3807 2.0597 1.3604 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9611 2.8680 2.5141 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1523 -2.0211 -0.4980 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0255 -0.6395 1.3990 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7854 0.6784 1.5162 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0174 -2.6244 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4212 -1.0936 2.7901 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4715 -2.6649 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0909 -2.7398 -1.0025 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0517 -1.7011 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1791 -2.1034 -1.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 -1.0343 -1.1561 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6679 -1.3680 -0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9662 0.2587 -1.6532 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6924 1.2454 -0.9865 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -0.3811 0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4062 0.9256 0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0249 1.7777 0.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6709 1.5730 -1.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4264 3.1287 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7851 3.6437 -3.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9549 2.0876 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0609 4.4992 -1.5513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0718 3.4248 -2.5679 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8979 1.1060 1.2933 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0651 -0.2651 0.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0142 3.1119 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8672 2.3190 3.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6052 2.6911 1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9297 -2.1677 -1.5626 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8221 -0.5103 0.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0061 -3.7139 0.2237 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0635 -2.2397 -0.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0511 -0.3375 3.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4585 -1.2065 3.4358 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5477 -2.1147 1.3916 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5191 -3.2202 -0.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6113 4.5733 3.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7305 -1.6893 -2.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8875 -2.8722 -2.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0078 -3.3730 -2.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0396 -4.4922 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5318 -4.1770 -0.8165 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 2.7268 0.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 3 38 1 0 0 0 0 4 39 1 0 0 0 0 5 40 1 0 0 0 0 6 41 1 0 0 0 0 7 24 2 0 0 0 0 8 25 2 0 0 0 0 9 27 1 0 0 0 0 9 63 1 0 0 0 0 10 30 2 0 0 0 0 11 33 1 0 0 0 0 11 68 1 0 0 0 0 12 33 2 0 0 0 0 13 35 2 0 0 0 0 14 42 1 0 0 0 0 14 69 1 0 0 0 0 15 20 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 16 28 1 0 0 0 0 16 51 1 0 0 0 0 17 26 1 0 0 0 0 17 30 1 0 0 0 0 17 54 1 0 0 0 0 18 29 1 0 0 0 0 18 35 1 0 0 0 0 18 61 1 0 0 0 0 19 34 1 0 0 0 0 19 66 1 0 0 0 0 19 67 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 31 1 0 0 0 0 28 33 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 29 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 62 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 38 41 1 0 0 0 0 39 40 2 0 0 0 0 40 42 1 0 0 0 0 41 42 2 0 0 0 0 M END $$$$