S1—C7A	1.7375 (12)	S2—N1	1.6678 (10)
S1—C2	1.7677 (12)	S2—C15	1.7597 (12)
C2—N3	1.3153 (15)	N1—N2	1.4020 (13)
C2—C8	1.4706 (15)	N1—H01	0.888 (18)
N3—C3A	1.3848 (14)	N4—H02	0.84 (2)
C3A—C4	1.3977 (17)	N4—H03	0.86 (2)
C3A—C7A	1.4013 (17)	C15—C20	1.3872 (17)
C4—C5	1.3855 (17)	C15—C16	1.3955 (17)
C4—H4	0.9500	C16—C17	1.3875 (17)
C5—C6	1.4031 (19)	C16—H16	0.9500
C5—H5	0.9500	C17—C18	1.3970 (18)
C6—C7	1.3880 (18)	C17—H17	0.9500
C6—H6	0.9500	C18—C19	1.3948 (18)
C7—C7A	1.4005 (16)	C18—C21	1.5034 (18)
C7—H7	0.9500	C19—C20	1.3894 (18)
C8—C9	1.4108 (16)	C19—H19	0.9500
C8—C12	1.4372 (15)	C20—H20	0.9500
C9—C10	1.3897 (16)	C21—H21A	0.9800
C9—S3	1.7781 (12)	C21—H21B	0.9800
C10—C13	1.4295 (16)	C21—H21C	0.9800
C10—C11	1.4340 (16)	C97—N99	1.4536 (17)
C11—O1	1.2213 (14)	C97—H97A	0.9800
C11—N2	1.4132 (14)	C97—H97B	0.9800
C12—N4	1.3124 (15)	C97—H97C	0.9800
C12—N2	1.3851 (14)	C98—N99	1.4554 (19)
C13—N5	1.1499 (17)	C98—H98A	0.9800
C14—S3	1.7952 (15)	C98—H98B	0.9800
C14—H14A	0.9800	C98—H98C	0.9800
C14—H14B	0.9800	C99—O99	1.2343 (15)
C14—H14C	0.9800	C99—N99	1.3242 (17)
S2—O3	1.4317 (10)	C99—H99	0.9500
S2—O2	1.4326 (9)
C7A—S1—C2	89.58 (6)	N2—N1—S2	117.20 (8)
N3—C2—C8	121.49 (10)	N2—N1—H01	113.6 (11)
N3—C2—S1	113.55 (8)	S2—N1—H01	113.1 (11)
C8—C2—S1	124.95 (9)	C12—N2—N1	115.94 (9)
C2—N3—C3A	112.58 (10)	C12—N2—C11	125.63 (10)
N3—C3A—C4	125.08 (11)	N1—N2—C11	117.88 (9)
N3—C3A—C7A	114.40 (10)	C12—N4—H02	121.2 (13)
C4—C3A—C7A	120.52 (11)	C12—N4—H03	114.9 (13)
C5—C4—C3A	118.33 (12)	H02—N4—H03	123.6 (18)
C5—C4—H4	120.8	C20—C15—C16	121.33 (11)
C3A—C4—H4	120.8	C20—C15—S2	120.72 (9)
C4—C5—C6	120.82 (12)	C16—C15—S2	117.94 (9)
C4—C5—H5	119.6	C17—C16—C15	118.80 (12)
C6—C5—H5	119.6	C17—C16—H16	120.6
C7—C6—C5	121.60 (11)	C15—C16—H16	120.6
C7—C6—H6	119.2	C16—C17—C18	121.22 (12)
C5—C6—H6	119.2	C16—C17—H17	119.4
C6—C7—C7A	117.34 (12)	C18—C17—H17	119.4
C6—C7—H7	121.3	C19—C18—C17	118.44 (11)
C7A—C7—H7	121.3	C19—C18—C21	121.38 (12)
C7—C7A—C3A	121.37 (11)	C17—C18—C21	120.17 (12)
C7—C7A—S1	128.74 (10)	C20—C19—C18	121.46 (12)
C3A—C7A—S1	109.88 (8)	C20—C19—H19	119.3
C9—C8—C12	116.48 (10)	C18—C19—H19	119.3
C9—C8—C2	125.41 (10)	C15—C20—C19	118.73 (11)
C12—C8—C2	118.11 (10)	C15—C20—H20	120.6
C10—C9—C8	122.53 (10)	C19—C20—H20	120.6
C10—C9—S3	115.37 (9)	C18—C21—H21A	109.5
C8—C9—S3	122.08 (9)	C18—C21—H21B	109.5
C9—C10—C13	122.46 (11)	H21A—C21—H21B	109.5
C9—C10—C11	122.30 (10)	C18—C21—H21C	109.5
C13—C10—C11	115.24 (10)	H21A—C21—H21C	109.5
O1—C11—N2	119.46 (11)	H21B—C21—H21C	109.5
O1—C11—C10	127.10 (11)	N99—C97—H97A	109.5
N2—C11—C10	113.44 (10)	N99—C97—H97B	109.5
N4—C12—N2	116.83 (10)	H97A—C97—H97B	109.5
N4—C12—C8	123.94 (11)	N99—C97—H97C	109.5
N2—C12—C8	119.23 (10)	H97A—C97—H97C	109.5
N5—C13—C10	176.92 (13)	H97B—C97—H97C	109.5
S3—C14—H14A	109.5	N99—C98—H98A	109.5
S3—C14—H14B	109.5	N99—C98—H98B	109.5
H14A—C14—H14B	109.5	H98A—C98—H98B	109.5
S3—C14—H14C	109.5	N99—C98—H98C	109.5
H14A—C14—H14C	109.5	H98A—C98—H98C	109.5
H14B—C14—H14C	109.5	H98B—C98—H98C	109.5
O3—S2—O2	121.42 (6)	O99—C99—N99	125.03 (13)
O3—S2—N1	102.99 (5)	O99—C99—H99	117.5
O2—S2—N1	106.32 (5)	N99—C99—H99	117.5
O3—S2—C15	106.76 (6)	C99—N99—C97	121.56 (12)
O2—S2—C15	109.03 (6)	C99—N99—C98	121.18 (12)
N1—S2—C15	109.88 (5)	C97—N99—C98	117.25 (12)
C9—S3—C14	98.98 (6)
C7A—S1—C2—N3	−0.89 (9)	C2—C8—C12—N4	−0.37 (17)
C7A—S1—C2—C8	178.19 (10)	C9—C8—C12—N2	−0.79 (15)
C8—C2—N3—C3A	−178.06 (10)	C2—C8—C12—N2	179.01 (10)
S1—C2—N3—C3A	1.06 (13)	C10—C9—S3—C14	83.40 (11)
C2—N3—C3A—C4	178.78 (11)	C8—C9—S3—C14	−98.15 (12)
C2—N3—C3A—C7A	−0.70 (14)	O3—S2—N1—N2	−167.59 (8)
N3—C3A—C4—C5	179.67 (11)	O2—S2—N1—N2	−38.90 (9)
C7A—C3A—C4—C5	−0.89 (17)	C15—S2—N1—N2	78.95 (9)
C3A—C4—C5—C6	−0.39 (18)	N4—C12—N2—N1	−3.39 (15)
C4—C5—C6—C7	0.93 (19)	C8—C12—N2—N1	177.19 (10)
C5—C6—C7—C7A	−0.15 (18)	N4—C12—N2—C11	−174.61 (10)
C6—C7—C7A—C3A	−1.15 (17)	C8—C12—N2—C11	5.97 (17)
C6—C7—C7A—S1	−179.72 (9)	S2—N1—N2—C12	103.12 (10)
N3—C3A—C7A—C7	−178.80 (11)	S2—N1—N2—C11	−84.95 (11)
C4—C3A—C7A—C7	1.70 (17)	O1—C11—N2—C12	172.21 (11)
N3—C3A—C7A—S1	0.01 (13)	C10—C11—N2—C12	−7.76 (16)
C4—C3A—C7A—S1	−179.49 (9)	O1—C11—N2—N1	1.15 (16)
C2—S1—C7A—C7	179.17 (12)	C10—C11—N2—N1	−178.82 (9)
C2—S1—C7A—C3A	0.47 (9)	O3—S2—C15—C20	152.17 (10)
N3—C2—C8—C9	−177.62 (11)	O2—S2—C15—C20	19.34 (12)
S1—C2—C8—C9	3.36 (16)	N1—S2—C15—C20	−96.82 (10)
N3—C2—C8—C12	2.61 (16)	O3—S2—C15—C16	−28.68 (11)
S1—C2—C8—C12	−176.41 (8)	O2—S2—C15—C16	−161.51 (9)
C12—C8—C9—C10	−1.79 (16)	N1—S2—C15—C16	82.33 (10)
C2—C8—C9—C10	178.44 (11)	C20—C15—C16—C17	−0.33 (18)
C12—C8—C9—S3	179.88 (8)	S2—C15—C16—C17	−179.47 (9)
C2—C8—C9—S3	0.10 (16)	C15—C16—C17—C18	−0.79 (19)
C8—C9—C10—C13	−179.23 (11)	C16—C17—C18—C19	1.19 (18)
S3—C9—C10—C13	−0.79 (15)	C16—C17—C18—C21	−177.66 (12)
C8—C9—C10—C11	−0.40 (18)	C17—C18—C19—C20	−0.49 (19)
S3—C9—C10—C11	178.04 (9)	C21—C18—C19—C20	178.35 (12)
C9—C10—C11—O1	−175.15 (12)	C16—C15—C20—C19	1.01 (18)
C13—C10—C11—O1	3.76 (18)	S2—C15—C20—C19	−179.87 (9)
C9—C10—C11—N2	4.82 (16)	C18—C19—C20—C15	−0.59 (19)
C13—C10—C11—N2	−176.27 (10)	O99—C99—N99—C97	−178.03 (13)
C9—C8—C12—N4	179.84 (11)	O99—C99—N99—C98	3.0 (2)