0 mol 15 unq 0 iso 0 dist 6.82505 9.97507 5.17568 7.12903 5.51916 5.90976 5.55659 9.78051 10.2713 8.96967 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 7.58835 7.2846 8.81358 6.34173 5.67689 4.71384 6.89191 9.20119 12.1257 8.59109 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.32874 6.81627 5.47421 8.26899 4.55117 5.98837 6.75888 6.40841 10.335 8.80108 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 7.32874 9.55426 5.90225 8.26899 4.55117 10.3782 6.75888 6.40841 6.31428 8.80108 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 6.86465 6.62496 5.30792 9.58673 5.92889 10.2241 6.47744 8.63333 11.5023 7.01363 numMergedOcc 0
5 mol 58 unq 3 iso 0 dist 6.86465 6.35756 5.35073 9.58673 5.92889 7.05413 6.47744 8.63333 8.89374 7.01363 numMergedOcc 0
6 mol 58 unq 4 iso 0 dist 6.35756 6.86465 5.35073 9.58673 7.05413 5.92889 6.47744 8.89374 8.63333 7.01363 numMergedOcc 0
7 mol 58 unq 5 iso 0 dist 6.35756 6.62496 4.81926 9.58673 7.05413 10.2241 6.47744 8.89374 11.5023 7.01363 numMergedOcc 0
8 mol 58 unq 6 iso 0 dist 9.55426 6.81627 9.7274 8.26899 10.3782 5.98837 6.75888 6.31428 10.335 8.80108 numMergedOcc 0
9 mol 58 unq 7 iso 0 dist 9.55426 7.32874 5.90225 8.26899 10.3782 4.55117 6.75888 6.31428 6.40841 8.80108 numMergedOcc 0
10 mol 58 unq 8 iso 0 dist 9.55426 9.4099 10.6169 6.31428 6.75888 5.11205 10.3782 8.26899 13.7148 8.80108 numMergedOcc 0
11 mol 59 unq 0 iso 0 dist 7.71095 8.84665 12.5396 8.24062 5.3525 11.0387 5.33688 6.71911 12.8699 6.5096 numMergedOcc 0
12 mol 59 unq 1 iso 0 dist 7.71095 8.25513 8.19458 8.24062 5.3525 9.15805 5.33688 6.71911 11.6249 6.5096 numMergedOcc 0
13 mol 59 unq 2 iso 0 dist 7.71095 6.85766 10.0246 6.71911 5.33688 7.29033 5.3525 8.24062 10.6318 6.5096 numMergedOcc 0
14 mol 72 unq 0 iso 0 dist 9.96708 8.8178 10.7394 6.77912 7.11552 12.0644 9.0131 7.321 13.3133 9.19459 numMergedOcc 0
15 mol 72 unq 1 iso 0 dist 9.96708 9.78528 8.24309 7.321 9.0131 6.11922 7.11552 6.77912 11.9814 9.19459 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 9.33865 6.11741 8.02349 7.64585 10.2377 10.8939 10.7942 7.76729 12.9821 6.40036 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 9.33865 5.83991 7.69052 7.76729 10.7942 10.9739 10.2377 7.64585 12.2309 6.40036 numMergedOcc 0
18 mol 127 unq 0 iso 0 dist 9.30299 8.14887 7.30196 8.59981 14.085 14.9761 4.77464 9.81878 11.7714 6.3244 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 6.23493 7.46303 5.71071 9.17284 4.9093 6.3437 6.3845 7.16254 9.14392 6.51096 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 7.46303 6.23493 5.71071 9.17284 6.3437 4.9093 6.3845 9.14392 7.16254 6.51096 numMergedOcc 0
21 mol 155 unq 2 iso 0 dist 7.46303 6.43582 7.66392 9.14392 6.3845 12.1814 6.3437 9.17284 12.2465 6.51096 numMergedOcc 0
22 mol 155 unq 3 iso 0 dist 6.43582 7.46303 7.66392 7.51198 6.34186 5.86939 8.27726 7.36102 12.1081 7.37901 numMergedOcc 0
23 mol 156 unq 0 iso 0 dist 7.44554 8.94056 5.56175 6.27641 7.29758 8.67156 6.29785 9.36805 13.1853 6.90155 numMergedOcc 0
24 mol 156 unq 1 iso 0 dist 7.44554 9.83699 8.38403 6.27641 7.29758 4.53931 6.29785 9.36805 7.55203 6.90155 numMergedOcc 0
25 mol 156 unq 2 iso 0 dist 9.83699 7.44554 8.38403 6.27641 4.53931 7.29758 6.29785 7.55203 9.36805 6.90155 numMergedOcc 0
26 mol 156 unq 3 iso 0 dist 9.83699 8.94056 11.2719 6.27641 4.53931 8.67156 6.29785 7.55203 13.1853 6.90155 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 9.0018 5.6234 6.2715 9.8589 8.22779 10.5631 11.0415 9.31887 12.816 4.79852 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 9.0018 6.57069 8.16421 9.8589 8.22779 7.5414 11.0415 9.31887 11.3137 4.79852 numMergedOcc 0
29 mol 175 unq 2 iso 0 dist 9.0018 7.652 7.42466 9.31887 11.0415 5.0384 8.22779 9.8589 7.24908 4.79852 numMergedOcc 0
30 mol 175 unq 3 iso 0 dist 7.652 9.92231 6.2715 7.24908 8.22779 10.5631 5.0384 9.31887 12.816 4.79852 numMergedOcc 0
31 mol 175 unq 4 iso 0 dist 7.652 9.0018 7.42466 9.31887 5.0384 11.0415 8.22779 7.24908 9.8589 4.79852 numMergedOcc 0
32 mol 181 unq 0 iso 0 dist 9.15386 9.1374 12.1628 6.94688 6.80228 6.25083 8.25067 9.6668 13.2702 8.20656 numMergedOcc 0
33 mol 181 unq 1 iso 0 dist 9.15386 9.1374 12.1628 6.71012 11.6919 4.77278 8.25067 9.6668 13.2702 9.40622 numMergedOcc 0
34 mol 181 unq 2 iso 0 dist 9.15386 5.98885 5.16002 6.94688 6.80228 5.86342 8.25067 9.6668 10.8351 8.20656 numMergedOcc 0
35 mol 181 unq 3 iso 0 dist 9.15386 5.98885 5.16002 6.71012 11.6919 9.14057 8.25067 9.6668 10.8351 9.40622 numMergedOcc 0
36 mol 224 unq 0 iso 0 dist 8.95269 6.57273 4.70378 6.87664 7.98696 7.12232 9.36098 7.06793 10.0414 8.89778 numMergedOcc 0
37 mol 224 unq 1 iso 0 dist 8.95269 6.57273 4.70378 6.87664 7.98696 7.12232 5.29877 6.67585 6.65984 9.47554 numMergedOcc 0
38 mol 224 unq 2 iso 0 dist 8.95269 5.78342 11.5372 6.87664 7.98696 5.3621 9.36098 7.06793 12.7072 8.89778 numMergedOcc 0
39 mol 224 unq 3 iso 0 dist 8.95269 5.78342 11.5372 6.87664 7.98696 5.3621 5.29877 6.67585 10.667 9.47554 numMergedOcc 0
40 mol 224 unq 4 iso 0 dist 6.57273 8.95269 4.70378 6.87664 7.12232 7.98696 5.29877 6.65984 6.67585 9.47554 numMergedOcc 0
41 mol 224 unq 5 iso 0 dist 6.57273 5.78342 8.49799 6.87664 7.12232 5.3621 5.29877 6.65984 10.667 9.47554 numMergedOcc 0
42 mol 224 unq 6 iso 0 dist 6.57273 6.60589 5.0744 6.65984 5.29877 6.12232 7.12232 6.87664 10.8259 9.47554 numMergedOcc 0
