@MOLECULE (2r)-1-(isopropylamino)-3-(1,3-thiazol-2-yloxy)-2-propanol 30 30 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.6635 -0.3720 -0.7412 S.2 1 UNL1111111111 0.1754 2 O 0.8232 -2.6910 0.7516 O.3 1 UNL1111111111 -0.5682 3 O -1.0542 -0.7757 -0.2364 O.3 1 UNL1111111111 -0.3182 4 N 3.0600 -0.1754 -0.5743 N.3 1 UNL1111111111 -0.5847 5 N -2.0646 1.1698 0.6683 N.ar 1 UNL1111111111 -0.4880 6 C 2.5962 -1.2227 0.3534 C.3 1 UNL1111111111 -0.1339 7 C 1.1303 -1.5474 -0.0240 C.3 1 UNL1111111111 0.1349 8 C 4.0068 0.7871 0.0474 C.3 1 UNL1111111111 0.1095 9 C 0.2110 -0.3837 0.3539 C.3 1 UNL1111111111 -0.0858 10 C 3.1841 1.8935 0.7285 C.3 1 UNL1111111111 -0.4562 11 C 4.9028 1.3904 -1.0460 C.3 1 UNL1111111111 -0.4803 12 C -2.0702 0.0482 -0.0250 C.ar 1 UNL1111111111 0.2912 13 C -4.3013 1.0913 -0.0261 C.ar 1 UNL1111111111 -0.3921 14 C -3.3327 1.7606 0.6650 C.ar 1 UNL1111111111 0.0557 15 H 3.1971 -2.1564 0.3052 H 1 UNL1111111111 0.1379 16 H 2.6414 -0.8812 1.4094 H 1 UNL1111111111 0.1530 17 H 1.0261 -1.8188 -1.0980 H 1 UNL1111111111 0.1396 18 H 4.6551 0.2856 0.8122 H 1 UNL1111111111 0.1093 19 H 3.4355 -0.5789 -1.4280 H 1 UNL1111111111 0.2638 20 H 0.5399 0.5746 -0.0922 H 1 UNL1111111111 0.1758 21 H 0.0786 -0.2670 1.4424 H 1 UNL1111111111 0.1567 22 H 3.8309 2.6560 1.1696 H 1 UNL1111111111 0.1396 23 H 2.5200 2.3860 0.0060 H 1 UNL1111111111 0.1619 24 H 2.5454 1.4888 1.5211 H 1 UNL1111111111 0.1488 25 H 5.5511 0.6384 -1.5057 H 1 UNL1111111111 0.1417 26 H 5.5483 2.1738 -0.6346 H 1 UNL1111111111 0.1513 27 H 4.3016 1.8486 -1.8418 H 1 UNL1111111111 0.1611 28 H -0.1391 -2.8668 0.7252 H 1 UNL1111111111 0.3298 29 H -5.3287 1.3764 -0.1474 H 1 UNL1111111111 0.1901 30 H -3.4374 2.6940 1.2092 H 1 UNL1111111111 0.1802 @BOND 1 1 12 ar 2 1 13 ar 3 2 7 1 4 2 28 1 5 3 9 1 6 3 12 1 7 4 6 1 8 4 8 1 9 4 19 1 10 5 12 ar 11 5 14 ar 12 6 7 1 13 6 15 1 14 6 16 1 15 7 9 1 16 7 17 1 17 8 10 1 18 8 11 1 19 8 18 1 20 9 20 1 21 9 21 1 22 10 22 1 23 10 23 1 24 10 24 1 25 11 25 1 26 11 26 1 27 11 27 1 28 13 14 ar 29 13 29 1 30 14 30 1