@MOLECULE valproyl-2-pyrrolidinone 36 36 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.0011 -0.9416 -1.9386 O.2 1 UNL1111111111 -0.5058 2 O 1.0890 0.2436 1.9061 O.2 1 UNL1111111111 -0.5043 3 N 1.3930 -0.5370 -0.2419 N.am 1 UNL1111111111 -0.5733 4 C -1.0771 -0.0332 0.0067 C.3 1 UNL1111111111 -0.1996 5 C -2.2545 -0.9927 -0.2428 C.3 1 UNL1111111111 -0.2703 6 C -1.4033 1.3937 -0.4667 C.3 1 UNL1111111111 -0.2663 7 C 0.0974 -0.5336 -0.8026 C.2 1 UNL1111111111 0.6045 8 C 2.5181 -0.9977 -1.0892 C.3 1 UNL1111111111 -0.0616 9 C 3.7856 -0.8877 -0.2093 C.3 1 UNL1111111111 -0.2835 10 C 3.3191 -0.3433 1.1478 C.3 1 UNL1111111111 -0.3540 11 C 1.8207 -0.1607 1.0390 C.2 1 UNL1111111111 0.6155 12 C -3.3558 -0.8029 0.8074 C.3 1 UNL1111111111 -0.2427 13 C -0.3430 2.4000 -0.0040 C.3 1 UNL1111111111 -0.2595 14 C -4.5129 -1.7686 0.5532 C.3 1 UNL1111111111 -0.4381 15 C -0.7176 3.8165 -0.4367 C.3 1 UNL1111111111 -0.4345 16 H -0.8488 -0.0166 1.1036 H 1 UNL1111111111 0.1955 17 H -2.6582 -0.8438 -1.2632 H 1 UNL1111111111 0.1565 18 H -1.8984 -2.0416 -0.2229 H 1 UNL1111111111 0.1463 19 H -1.4992 1.4162 -1.5703 H 1 UNL1111111111 0.1515 20 H -2.3955 1.6912 -0.0742 H 1 UNL1111111111 0.1509 21 H 2.5839 -0.3675 -2.0015 H 1 UNL1111111111 0.1538 22 H 2.3310 -2.0388 -1.4283 H 1 UNL1111111111 0.1554 23 H 4.5319 -0.2231 -0.6757 H 1 UNL1111111111 0.1510 24 H 4.2758 -1.8700 -0.1018 H 1 UNL1111111111 0.1506 25 H 3.8000 0.6194 1.4041 H 1 UNL1111111111 0.1778 26 H 3.5578 -1.0298 1.9825 H 1 UNL1111111111 0.1782 27 H -2.9444 -0.9629 1.8228 H 1 UNL1111111111 0.1381 28 H -3.7244 0.2405 0.7928 H 1 UNL1111111111 0.1350 29 H -0.2303 2.3526 1.0983 H 1 UNL1111111111 0.1526 30 H 0.6479 2.1305 -0.4138 H 1 UNL1111111111 0.1322 31 H -5.3088 -1.6393 1.2944 H 1 UNL1111111111 0.1380 32 H -4.9563 -1.6116 -0.4366 H 1 UNL1111111111 0.1429 33 H -4.1834 -2.8126 0.6039 H 1 UNL1111111111 0.1431 34 H -1.6773 4.1261 -0.0080 H 1 UNL1111111111 0.1422 35 H 0.0364 4.5416 -0.1110 H 1 UNL1111111111 0.1397 36 H -0.8002 3.8942 -1.5266 H 1 UNL1111111111 0.1423 @BOND 1 1 7 2 2 2 11 2 3 3 7 am 4 3 8 1 5 3 11 am 6 4 5 1 7 4 6 1 8 4 7 1 9 4 16 1 10 5 12 1 11 5 17 1 12 5 18 1 13 6 13 1 14 6 19 1 15 6 20 1 16 8 9 1 17 8 21 1 18 8 22 1 19 9 10 1 20 9 23 1 21 9 24 1 22 10 11 1 23 10 25 1 24 10 26 1 25 12 14 1 26 12 27 1 27 12 28 1 28 13 15 1 29 13 29 1 30 13 30 1 31 14 31 1 32 14 32 1 33 14 33 1 34 15 34 1 35 15 35 1 36 15 36 1