DR6730 -OEChem-08132116303D 27 28 0 0 0 0 0 0 0999 V2000 -3.4513 1.2604 -0.0046 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -0.7655 0.0083 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7538 -1.4524 0.0069 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0742 -1.2697 0.0095 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3046 0.1288 -0.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7189 -0.3443 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6584 1.0121 -0.0082 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6517 0.3783 1.2008 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6344 0.3210 -1.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3285 0.8199 1.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3113 0.7627 -1.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7213 1.4726 -0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8236 0.6952 -0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8219 -1.8669 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7786 -0.7869 0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -0.3654 0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2413 0.0348 -0.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2538 0.0770 0.8553 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1623 0.2304 2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1313 0.1281 -2.1616 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 1.0095 2.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8022 0.9073 -2.1654 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8299 2.5557 -0.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3477 -2.2748 0.9301 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8724 -2.1745 0.0309 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3351 -2.3175 -0.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2556 -2.2681 0.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 16 2 0 0 0 0 3 15 2 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 9 11 2 0 0 0 0 9 20 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 15 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$