@MOLECULE 2-deoxy-2-{[methyl(nitroso)carbamoyl]amino}-beta-d-glucopyranose 33 33 0 0 0 SMALL USER_CHARGES @ATOM 1 O -2.2882 -1.1114 -0.4181 O.3 1 UNL11111111 -0.4853 2 O -0.2686 2.3560 -0.2389 O.3 1 UNL11111111 -0.5768 3 O -2.8458 2.1019 1.0502 O.3 1 UNL11111111 -0.5508 4 O -0.5044 -2.4192 -0.7842 O.3 1 UNL11111111 -0.5332 5 O -5.0295 -1.3263 0.2157 O.3 1 UNL11111111 -0.5324 6 O 2.1438 1.0636 -1.4036 O.2 1 UNL11111111 -0.5488 7 O 4.9139 -1.0725 1.3616 O.2 1 UNL11111111 -0.2040 8 N 1.2457 -0.2846 0.1975 N.am 1 UNL11111111 -0.5779 9 N 3.6214 -0.0238 -0.0202 N.am 1 UNL11111111 -0.4146 10 N 3.7981 -0.8948 0.9935 N.2 1 UNL11111111 0.2020 11 C -0.7420 1.1625 0.3438 C.3 1 UNL11111111 0.0777 12 C -0.1088 -0.0822 -0.3239 C.3 1 UNL11111111 -0.0653 13 C -2.2674 1.2323 0.1021 C.3 1 UNL11111111 0.0668 14 C -2.9487 -0.1231 0.3603 C.3 1 UNL11111111 0.0535 15 C -0.9567 -1.3538 -0.0169 C.3 1 UNL11111111 0.3442 16 C -4.3847 -0.1379 -0.1764 C.3 1 UNL11111111 -0.0165 17 C 2.3009 0.2846 -0.4803 C.2 1 UNL11111111 0.7240 18 C 4.7498 0.6587 -0.6746 C.3 1 UNL11111111 -0.2626 19 H -0.4948 1.2136 1.4302 H 1 UNL11111111 0.1523 20 H -0.0788 0.0797 -1.4384 H 1 UNL11111111 0.1912 21 H -2.4852 1.6261 -0.9176 H 1 UNL11111111 0.1525 22 H -2.9188 -0.4052 1.4364 H 1 UNL11111111 0.1545 23 H -0.9038 -1.7058 1.0345 H 1 UNL11111111 0.1429 24 H -4.4182 -0.0487 -1.2759 H 1 UNL11111111 0.1308 25 H -4.9892 0.6663 0.2927 H 1 UNL11111111 0.1670 26 H 1.3925 -1.0063 0.8927 H 1 UNL11111111 0.3389 27 H 0.6304 2.2363 -0.6205 H 1 UNL11111111 0.3559 28 H -2.3911 2.9755 1.0138 H 1 UNL11111111 0.3411 29 H -0.8876 -2.4037 -1.6896 H 1 UNL11111111 0.3439 30 H -4.5230 -2.0991 -0.1155 H 1 UNL11111111 0.3218 31 H 5.3715 -0.0716 -1.2232 H 1 UNL11111111 0.1609 32 H 5.3826 1.1625 0.0761 H 1 UNL11111111 0.1611 33 H 4.3961 1.4186 -1.3983 H 1 UNL11111111 0.1852 @BOND 1 29 4 1 2 20 12 1 3 6 17 2 4 33 18 1 5 24 16 1 6 31 18 1 7 21 13 1 8 4 15 1 9 18 9 1 10 18 32 1 11 27 2 1 12 17 9 am 13 17 8 am 14 1 15 1 15 1 14 1 16 12 15 1 17 12 8 1 18 12 11 1 19 2 11 1 20 16 5 1 21 16 25 1 22 16 14 1 23 30 5 1 24 9 10 1 25 15 23 1 26 13 11 1 27 13 14 1 28 13 3 1 29 8 26 1 30 11 19 1 31 14 22 1 32 28 3 1 33 10 7 2