(R)-(methylenehydroxy)methyl morpholinium in GB/SA water
Conformation	δE	Stat. point	4,5,6,1	5,6,1,2	6,1,2,3	1,2,3,4	2,3,4,5	3,4,5,6	O-C-C-O	C-C-O-H	Solvation
C	0.00	min	44.1	-51.4	58.8	-58.6	50.1	-43.5	-48.2	35.5	-59.59
C	0.81	min	43.7	-51.7	59.5	-59.0	49.9	-43.0	44.4	-42.5	-56.84
C	0.86	min	-41.1	50.4	-59.9	60.1	-49.8	40.9	-42.8	27.0	-59.57
TB	1.45	min	19.8	40.3	-63.5	23.0	34.4	-57.0	-44.7	29.4	-58.46
TB	1.79	min	-17.6	-41.8	62.4	-20.2	-36.3	56.3	-45.6	32.9	-58.51
TB	1.90	min	13.6	-57.4	41.3	17.1	-57.5	41.3	-49.5	36.0	-58.34
TB	2.62	min	15.8	-58.9	41.4	17.7	-57.3	39.7	46.9	-46.5	-54.83
C	2.87	min	43.2	-51.7	59.9	-59.0	49.6	-42.5	-56.8	-65.8	-60.77
C	3.20	min	43.1	-50.5	58.7	-59.1	50.5	-43.2	55.2	-172.7	-55.44
C	3.31	min	-42.8	52.2	-60.8	59.5	-49.3	41.8	-52.5	-179.0	-60.22
TB	3.48	min	48.4	-8.4	-46.0	67.2	-26.4	-27.1	-45.7	33.2	-60.20
TB	4.06	min	-7.7	53.3	-41.7	-14.7	56.8	-44.9	70.0	-177.4	-50.52
TB	4.14	min	19.2	41.2	-64.0	22.6	34.6	-56.9	-53.2	179.6	-58.31
C	4.42	min	-38.1	47.0	-57.9	60.0	-50.2	39.9	63.3	-173.9	-52.24
TB	4.52	min	5.2	-53.4	45.1	10.9	-55.5	47.0	60.2	-172.4	-52.11
TB	4.56	min	14.1	-58.1	42.1	16.6	-57.1	40.9	-55.1	-53.1	-59.27
TB	4.57	min	48.7	-9.4	-45.1	67.2	-27.1	-26.5	46.6	-46.8	-57.10
TB	4.66	min	-12.6	58.0	-43.7	-14.9	56.6	-42.1	-49.8	-178.7	-58.12
TB	4.68	min	-42.8	3.4	49.3	-68.7	28.2	23.4	-47.9	33.4	-60.28
TB	4.84	min	-18.4	-41.6	63.2	-21.2	-35.3	56.6	-56.2	178.2	-58.63
C	4.95	min	44.7	-51.6	58.7	-58.2	50.2	-44.2	178.9	176.4	-53.66
TB	4.98	min	23.9	34.6	-59.0	21.3	34.3	-58.3	57.7	-79.4	-53.81
TB	5.11	min	42.8	-2.5	54.3	-65.8	20.2	30.7	34.6	-45.2	-54.89
B	5.18	saddle	10.2	42.1	-46.7	-2.2	50.8	-55.3	62.5	-92.5	-52.60
C	5.20	min	-47.9	52.9	-58.1	56.8	-50.4	46.8	168.4	172.5	-53.03
TB	6.34	min	45.4	-3.4	-50.2	68.0	-25.3	-27.3	58.3	-173.4	-55.40
TB	6.45	min	47.8	-7.6	-46.7	67.3	-26.4	-27.0	-55.6	177.0	-60.40
TB	6.63	min	20.8	39.6	-63.9	23.7	33.6	-57.4	-177.6	175.9	-53.15
TB	6.91	min	-42.7	2.3	50.0	-67.6	26.3	24.9	50.2	-169.3	-53.55
TB	7.22	min	-45.7	6.4	47.2	-68.0	27.9	24.8	-56.6	-64.4	-60.93
TB	7.24	min	16.0	-58.6	40.7	18.5	-57.5	39.4	178.9	176.5	-52.68
TB	7.30	min	-20.3	-39.9	63.5	-22.9	-34.1	57.2	-177.2	174.9	-53.21
B	7.44	saddle	-6.1	54.3	-45.5	-11.1	55.5	-46.4	-171.5	175.5	-53.61
B	7.65	saddle	-33.9	-15.6	63.2	-63.8	14.7	31.9	-58.7	177.6	-60.59
TB	7.88	saddle	-20.3	-39.9	63.4	-22.9	-34.2	57.2	-176.7	118.5	-52.85
TB	8.53	min	48.1	-7.2	-47.1	67.1	-25.6	-27.8	-176.6	176.3	-54.25
T½C	8.54	saddle	6.1	19.4	-55.4	69.7	-43.7	7.5	56.6	-65.5	-55.07
TB	8.84	min	48.1	-7.0	-47.3	67.0	-25.4	-28.1	-174.8	76.9	-55.81
TB	8.95	min	-50.2	9.7	45.2	-66.4	25.4	28.7	173.8	172.2	-53.65
half-C	9.67	mm	-16.3	-6.0	-7.7	44.2	-64.1	50.1	-51.1	178.0	-60.15
half-C	17.68	saddle	55.8	-26.7	-3.0	7.5	19.1	-50.3	-174.7	176.2	-54.17