s-mde0001.mol 32 33 0 0 0 0 0 0 0 0 0 -2.4664 -1.1718 0.1598 C 0 0 0 0 0 -2.2722 -0.3972 1.2339 C 0 0 0 0 0 -1.1340 0.3118 1.3152 C 0 0 0 0 0 -1.5511 -1.2363 -0.8047 C 0 0 0 0 0 -0.4161 -0.5302 -0.7252 C 0 0 0 0 0 -0.1984 0.2559 0.3465 C 0 0 0 0 0 -1.9562 -2.0745 -1.7899 O 0 0 0 0 0 -3.2290 -2.5585 -1.3875 C 0 0 0 0 0 -3.5267 -1.9634 -0.1332 O 0 0 0 0 0 1.0730 1.0721 0.4614 C 0 0 0 0 0 0.8435 2.5310 0.0238 C 0 0 0 0 0 2.1453 3.3386 0.1489 C 0 0 0 0 0 0.3381 2.5087 -1.3347 N 0 0 0 0 0 -0.0681 3.7878 -1.8714 C 0 0 0 0 0 -0.7302 3.5815 -3.2392 C 0 0 0 0 0 -3.0355 -0.3463 2.0285 H 0 0 0 0 0 -0.9692 0.9554 2.1960 H 0 0 0 0 0 0.3217 -0.5995 -1.5414 H 0 0 0 0 0 -3.1760 -3.6646 -1.2630 H 0 0 0 0 0 -3.9930 -2.2386 -2.1332 H 0 0 0 0 0 1.4355 1.0389 1.5159 H 0 0 0 0 0 1.8826 0.6163 -0.1556 H 0 0 0 0 0 1.9812 4.4279 -0.0144 H 0 0 0 0 0 2.5819 3.2351 1.1687 H 0 0 0 0 0 2.9073 2.9884 -0.5847 H 0 0 0 0 0 1.0244 2.0767 -1.9534 H 0 0 0 0 0 -0.7933 4.2744 -1.1774 H 0 0 0 0 0 0.8199 4.4498 -1.9948 H 0 0 0 0 0 -1.0603 4.5528 -3.6756 H 0 0 0 0 0 -0.0248 3.1061 -3.9596 H 0 0 0 0 0 -1.6262 2.9237 -3.1542 H 0 0 0 0 0 0.0672 2.9794 0.6903 H 0 0 0 0 0 1 2 0 0 0 0 1 4 0 0 0 0 1 9 0 0 0 0 2 3 0 0 0 0 2 16 0 0 0 0 3 6 0 0 0 0 3 17 0 0 0 0 4 5 0 0 0 0 4 7 0 0 0 0 5 6 0 0 0 0 5 18 0 0 0 0 6 10 0 0 0 0 7 8 0 0 0 0 8 9 0 0 0 0 8 19 0 0 0 0 8 20 0 0 0 0 10 11 0 0 0 0 10 21 0 0 0 0 10 22 0 0 0 0 11 12 0 0 0 0 11 13 0 0 0 0 11 32 0 0 0 0 12 23 0 0 0 0 12 24 0 0 0 0 12 25 0 0 0 0 13 14 0 0 0 0 13 26 0 0 0 0 14 15 0 0 0 0 14 27 0 0 0 0 14 28 0 0 0 0 15 29 0 0 0 0 15 30 0 0 0 0 15 31 0 0 0 0 M END