@MOLECULE n,n,2-trimethylpropanamide 21 20 0 0 0 SMALL USER_CHARGES @ATOM 1 C 1.2333 -0.4135 0.2671 C.3 1 UNL111111111 -0.1470 2 C 1.7325 -1.0266 -1.0425 C.3 1 UNL111111111 -0.4439 3 C 2.2826 0.5232 0.8698 C.3 1 UNL111111111 -0.4352 4 C -0.0134 0.4089 -0.0411 C.2 1 UNL111111111 0.5664 5 O 0.0561 1.5605 -0.4290 O.2 1 UNL111111111 -0.5493 6 N -1.2598 -0.1445 0.1888 N.am 1 UNL111111111 -0.4854 7 C -2.4495 0.6496 -0.1311 C.3 1 UNL111111111 -0.2278 8 C -1.4982 -1.5732 0.3796 C.3 1 UNL111111111 -0.2289 9 H 1.0095 -1.2199 1.0050 H 1 UNL111111111 0.1464 10 H 1.9299 -0.2484 -1.7933 H 1 UNL111111111 0.1650 11 H 2.6691 -1.5761 -0.8901 H 1 UNL111111111 0.1522 12 H 1.0053 -1.7195 -1.4777 H 1 UNL111111111 0.1404 13 H 2.4797 1.3767 0.2027 H 1 UNL111111111 0.1717 14 H 1.9423 0.9435 1.8236 H 1 UNL111111111 0.1492 15 H 3.2302 0.0054 1.0443 H 1 UNL111111111 0.1446 16 H -2.8344 0.4233 -1.1394 H 1 UNL111111111 0.1332 17 H -3.2411 0.4630 0.6135 H 1 UNL111111111 0.1389 18 H -2.2060 1.7318 -0.1024 H 1 UNL111111111 0.1771 19 H -1.7003 -1.7811 1.4479 H 1 UNL111111111 0.1443 20 H -2.3695 -1.9158 -0.2074 H 1 UNL111111111 0.1442 21 H -0.6391 -2.1872 0.0624 H 1 UNL111111111 0.1439 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 2 5 4 6 am 6 6 7 1 7 6 8 1 8 1 9 1 9 2 10 1 10 2 11 1 11 2 12 1 12 3 13 1 13 3 14 1 14 3 15 1 15 7 16 1 16 7 17 1 17 7 18 1 18 8 19 1 19 8 20 1 20 8 21 1