Testing Kemia javascript interface
Enter SMILES:
Enter MOL:
example CDK 4/2/08,10:35 25 26 0 0 0 0 0 0 0 0999 V2000 10.5833 42.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2843 42.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2843 44.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5833 45.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8824 44.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8824 42.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3090 42.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1906 43.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3090 44.8385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6192 40.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5475 40.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8071 43.1355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7713 41.4655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0392 41.3832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7713 45.7845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8071 44.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0392 45.8668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6989 41.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6080 41.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5475 46.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6192 46.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6080 45.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6989 46.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3054 42.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3054 44.6287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 6 14 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 5 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 M END
Kemia
Read MOL: