@MOLECULE 1-[(2-hydroxypropyl)(nitroso)amino]acetone 23 22 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.4065 0.1485 -0.2485 O.3 1 UNL1111111111 -0.5604 2 O 1.1028 1.8746 -0.0002 O.2 1 UNL1111111111 -0.4417 3 O 1.1165 -2.2985 0.7192 O.2 1 UNL1111111111 -0.3144 4 N 0.1269 -0.7991 -0.4727 N.pl3 1 UNL1111111111 -0.3212 5 N 0.0741 -1.8144 0.3725 N.2 1 UNL1111111111 0.2072 6 C -1.1362 -0.1646 -0.8893 C.3 1 UNL1111111111 -0.1291 7 C -2.1021 0.0930 0.3056 C.3 1 UNL1111111111 0.1717 8 C 1.3804 -0.2593 -1.0107 C.3 1 UNL1111111111 -0.2447 9 C -1.8857 1.4575 0.9419 C.3 1 UNL1111111111 -0.4713 10 C 1.8382 0.9389 -0.1761 C.2 1 UNL1111111111 0.4855 11 C 3.2256 0.8816 0.3673 C.3 1 UNL1111111111 -0.5517 12 H -0.9122 0.8042 -1.3917 H 1 UNL1111111111 0.1709 13 H -1.6433 -0.8118 -1.6417 H 1 UNL1111111111 0.1519 14 H -2.0551 -0.7267 1.0550 H 1 UNL1111111111 0.1324 15 H 1.2440 0.0604 -2.0687 H 1 UNL1111111111 0.1720 16 H 2.1572 -1.0628 -1.0225 H 1 UNL1111111111 0.1818 17 H -2.5542 1.6043 1.7984 H 1 UNL1111111111 0.1586 18 H -2.0958 2.2689 0.2307 H 1 UNL1111111111 0.1664 19 H -0.8502 1.5834 1.2849 H 1 UNL1111111111 0.1697 20 H -3.7683 -0.7458 -0.3887 H 1 UNL1111111111 0.3131 21 H 3.3335 0.0570 1.0902 H 1 UNL1111111111 0.1893 22 H 3.9744 0.7272 -0.4202 H 1 UNL1111111111 0.1769 23 H 3.4905 1.8118 0.8966 H 1 UNL1111111111 0.1869 @BOND 1 1 7 1 2 1 20 1 3 2 10 2 4 3 5 2 5 4 5 1 6 4 6 1 7 4 8 1 8 6 7 1 9 6 12 1 10 6 13 1 11 7 9 1 12 7 14 1 13 8 10 1 14 8 15 1 15 8 16 1 16 9 17 1 17 9 18 1 18 9 19 1 19 10 11 1 20 11 21 1 21 11 22 1 22 11 23 1