0 mol 15 unq 0 iso 0 dist 8.38064 9.97507 9.03536 5.90976 8.21493 7.12903 10.2713 5.01321 5.55659 8.96967 5.17568 10.4158 6.82505 5.51916 9.78051 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 9.97507 8.38064 9.03536 5.90976 7.12903 8.21493 10.2713 5.55659 5.01321 8.96967 5.17568 6.82505 10.4158 5.51916 9.78051 numMergedOcc 0
2 mol 15 unq 2 iso 0 dist 6.82505 9.97507 5.17568 5.55659 9.78051 10.2713 7.12903 5.51916 5.90976 8.96967 9.03536 10.4158 8.38064 5.01321 8.21493 numMergedOcc 0
3 mol 45 unq 0 iso 0 dist 6.43774 7.2846 5.24762 4.71384 7.06308 6.34173 12.1257 9.01651 6.89191 8.59109 8.81358 11.2563 7.58835 5.67689 9.20119 numMergedOcc 0
4 mol 45 unq 1 iso 0 dist 7.2846 6.43774 5.24762 4.71384 6.34173 7.06308 12.1257 6.89191 9.01651 8.59109 8.81358 7.58835 11.2563 5.67689 9.20119 numMergedOcc 0
5 mol 45 unq 2 iso 0 dist 7.58835 7.2846 8.81358 6.89191 9.20119 12.1257 6.34173 5.67689 4.71384 8.59109 5.24762 11.2563 6.43774 9.01651 7.06308 numMergedOcc 0
6 mol 45 unq 3 iso 0 dist 7.58835 7.2846 8.81358 6.89191 9.20119 12.1257 6.34173 5.67689 4.71384 8.59109 5.101 11.5838 10.8302 5.54436 9.43442 numMergedOcc 0
7 mol 45 unq 4 iso 0 dist 7.58835 7.2846 8.81358 6.89191 9.20119 12.1257 14.4997 16.2375 18.248 8.13782 13.7975 15.0348 19.507 7.39653 6.99408 numMergedOcc 0
8 mol 45 unq 5 iso 0 dist 7.58835 7.2846 8.81358 6.89191 9.20119 12.1257 14.4997 16.2375 18.248 8.13782 15.685 19.2693 21.9908 10.6095 9.3403 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 7.32874 6.81627 5.47421 6.75888 6.40841 10.335 8.26899 4.55117 5.98837 8.80108 7.08557 10.1508 12.0187 6.78077 9.33535 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 7.32874 9.55426 5.90225 6.75888 6.40841 6.31428 8.26899 4.55117 10.3782 8.80108 7.08557 10.1508 12.7357 6.78077 9.33535 numMergedOcc 0
11 mol 58 unq 2 iso 0 dist 6.64012 9.4099 6.47414 5.24906 6.46761 9.73139 10.9283 6.61756 8.94672 7.01363 9.94737 10.3224 15.4557 6.47744 9.58673 numMergedOcc 0
12 mol 58 unq 3 iso 0 dist 6.64012 9.4099 6.47414 5.11205 7.58407 6.31428 13.7148 14.7581 10.3782 8.80108 8.84991 13.9483 12.7357 6.78077 9.33535 numMergedOcc 0
13 mol 58 unq 4 iso 0 dist 6.64012 9.4099 6.47414 5.11205 7.58407 6.31428 13.7148 14.7581 10.3782 8.80108 10.6169 13.4544 9.55426 6.75888 8.26899 numMergedOcc 0
14 mol 58 unq 5 iso 0 dist 9.4099 6.64012 6.47414 5.24906 9.73139 6.46761 10.9283 8.94672 6.61756 7.01363 9.94737 15.4557 10.3224 6.47744 9.58673 numMergedOcc 0
15 mol 58 unq 6 iso 0 dist 9.4099 6.64012 6.47414 5.11205 6.31428 7.58407 13.7148 10.3782 14.7581 8.80108 8.84991 12.7357 13.9483 6.78077 9.33535 numMergedOcc 0
16 mol 58 unq 7 iso 0 dist 9.4099 6.64012 6.47414 5.11205 6.31428 7.58407 13.7148 10.3782 14.7581 8.80108 10.6169 9.55426 13.4544 6.75888 8.26899 numMergedOcc 0
17 mol 58 unq 8 iso 0 dist 9.55426 6.81627 9.7274 13.1021 9.73139 15.9764 16.3779 8.94672 16.6063 7.01363 19.4068 15.4557 22.3985 6.47744 9.58673 numMergedOcc 0
18 mol 58 unq 9 iso 0 dist 9.55426 6.81627 9.7274 6.75888 6.31428 10.335 8.26899 10.3782 5.98837 8.80108 7.08557 12.7357 12.0187 6.78077 9.33535 numMergedOcc 0
19 mol 58 unq 10 iso 0 dist 9.55426 7.32874 5.90225 13.1021 9.73139 10.9482 16.3779 8.94672 11.2323 7.01363 19.4068 15.4557 17.226 6.47744 9.58673 numMergedOcc 0
20 mol 58 unq 11 iso 0 dist 9.55426 7.32874 5.90225 6.75888 6.31428 6.40841 8.26899 10.3782 4.55117 8.80108 7.08557 12.7357 10.1508 6.78077 9.33535 numMergedOcc 0
21 mol 58 unq 12 iso 0 dist 9.55426 9.4099 10.6169 10.3782 8.26899 13.7148 6.31428 6.75888 5.11205 8.80108 5.90225 7.32874 11.396 4.55117 6.40841 numMergedOcc 0
22 mol 58 unq 13 iso 0 dist 9.55426 9.4099 10.6169 10.3782 8.26899 13.7148 6.31428 6.75888 5.11205 8.80108 6.47414 13.4544 6.64012 14.7581 7.58407 numMergedOcc 0
23 mol 72 unq 0 iso 0 dist 9.96708 8.8178 10.7394 9.0131 7.321 13.3133 6.77912 7.11552 12.0644 9.19459 5.36766 10.8086 12.8385 6.00418 8.624 numMergedOcc 0
24 mol 115 unq 0 iso 0 dist 5.83991 7.30858 10.8507 10.9739 7.76729 17.6696 12.2309 10.2377 19.2193 6.40036 7.69052 9.33865 13.8473 10.7942 7.64585 numMergedOcc 0
25 mol 115 unq 1 iso 0 dist 5.83991 7.88312 8.02349 10.9739 7.76729 12.9821 12.2309 10.2377 10.8939 6.40036 7.69052 9.33865 6.11741 10.7942 7.64585 numMergedOcc 0
26 mol 115 unq 2 iso 0 dist 6.11741 7.88312 7.69052 10.8939 7.64585 12.2309 12.9821 10.7942 10.9739 6.40036 8.02349 9.33865 5.83991 10.2377 7.76729 numMergedOcc 0
27 mol 127 unq 0 iso 0 dist 9.30299 8.14887 7.30196 4.77464 9.81878 11.7714 8.59981 14.085 14.9761 6.3244 11.279 17.6472 19.0925 8.00931 6.192 numMergedOcc 0
28 mol 127 unq 1 iso 0 dist 9.30299 8.14887 7.30196 4.77464 9.81878 11.7714 8.59981 14.085 14.9761 6.3244 11.4958 15.0647 18.4772 6.85862 7.69308 numMergedOcc 0
29 mol 127 unq 2 iso 0 dist 9.30299 8.14887 7.30196 4.77464 9.81878 11.7714 8.59981 14.085 14.9761 6.3244 5.55757 14.7391 12.8743 7.11695 7.66331 numMergedOcc 0
30 mol 155 unq 0 iso 0 dist 6.23493 7.46303 5.71071 6.3845 7.16254 9.14392 9.17284 4.9093 6.3437 6.51096 10.6882 12.1555 12.3052 5.48883 9.87281 numMergedOcc 0
31 mol 155 unq 1 iso 0 dist 6.23493 7.46303 5.71071 6.3845 7.16254 9.14392 9.17284 4.9093 6.3437 6.51096 12.1545 11.6934 13.4817 5.77564 8.87452 numMergedOcc 0
32 mol 155 unq 2 iso 0 dist 6.23493 7.46303 5.71071 6.3845 7.16254 9.14392 13.2459 10.7896 9.99927 8.73171 10.6882 12.1555 12.3052 5.48883 8.27111 numMergedOcc 0
33 mol 155 unq 3 iso 0 dist 6.23493 7.46303 5.71071 6.3845 7.16254 9.14392 13.2459 10.7896 9.99927 8.73171 12.1545 11.6934 13.4817 5.77564 7.68368 numMergedOcc 0
34 mol 155 unq 4 iso 0 dist 6.23493 7.46303 5.71071 5.86939 9.86313 7.51198 12.1081 13.5062 8.27726 7.37901 10.7349 13.5605 10.7829 5.40375 7.39644 numMergedOcc 0
35 mol 155 unq 5 iso 0 dist 6.23493 7.46303 5.71071 5.86939 9.86313 7.51198 12.1081 13.5062 8.27726 7.37901 7.66392 10.2463 6.43582 6.34186 7.36102 numMergedOcc 0
36 mol 155 unq 6 iso 0 dist 7.46303 6.23493 5.71071 6.3845 9.14392 7.16254 9.17284 6.3437 4.9093 6.51096 10.6882 12.3052 12.1555 5.48883 9.87281 numMergedOcc 0
37 mol 155 unq 7 iso 0 dist 7.46303 6.23493 5.71071 6.3845 9.14392 7.16254 9.17284 6.3437 4.9093 6.51096 12.1545 13.4817 11.6934 5.77564 8.87452 numMergedOcc 0
38 mol 155 unq 8 iso 0 dist 7.46303 6.23493 5.71071 6.3845 9.14392 7.16254 13.2459 9.99927 10.7896 8.73171 10.6882 12.3052 12.1555 5.48883 8.27111 numMergedOcc 0
39 mol 155 unq 9 iso 0 dist 7.46303 6.23493 5.71071 6.3845 9.14392 7.16254 13.2459 9.99927 10.7896 8.73171 12.1545 13.4817 11.6934 5.77564 7.68368 numMergedOcc 0
40 mol 155 unq 10 iso 0 dist 7.46303 6.23493 5.71071 5.86939 7.51198 9.86313 12.1081 8.27726 13.5062 7.37901 10.7349 10.7829 13.5605 5.40375 7.39644 numMergedOcc 0
41 mol 155 unq 11 iso 0 dist 7.46303 6.23493 5.71071 5.86939 7.51198 9.86313 12.1081 8.27726 13.5062 7.37901 7.66392 6.43582 10.2463 6.34186 7.36102 numMergedOcc 0
42 mol 155 unq 12 iso 0 dist 7.46303 6.43582 7.66392 6.3437 9.17284 12.2465 9.14392 6.3845 12.1814 6.51096 5.71071 6.23493 10.2463 4.9093 7.16254 numMergedOcc 0
43 mol 155 unq 13 iso 0 dist 6.43582 7.46303 7.66392 8.27726 7.36102 12.1081 7.51198 6.34186 5.86939 7.37901 5.71071 10.2463 6.23493 13.5062 9.86313 numMergedOcc 0
44 mol 156 unq 0 iso 0 dist 8.94056 7.66148 10.1658 8.67156 6.27641 10.9818 13.1853 6.29785 15.7866 6.90155 11.1775 10.4649 17.4119 9.30783 8.47155 numMergedOcc 0
45 mol 156 unq 1 iso 0 dist 8.94056 7.66148 10.1658 8.67156 6.27641 10.9818 13.1853 6.29785 15.7866 6.90155 5.56175 7.44554 12.0598 7.29758 9.36805 numMergedOcc 0
46 mol 156 unq 2 iso 0 dist 8.94056 7.66148 10.1658 8.67156 6.27641 10.9818 13.1853 6.29785 15.7866 6.90155 11.2719 9.83699 15.1382 4.53931 7.55203 numMergedOcc 0
47 mol 175 unq 0 iso 0 dist 9.0018 5.6234 6.2715 11.0415 9.31887 12.816 9.8589 8.22779 10.5631 4.79852 7.42466 7.652 9.92231 5.0384 7.24908 numMergedOcc 0
48 mol 175 unq 1 iso 0 dist 9.0018 6.57069 8.16421 11.0415 9.31887 11.3137 9.8589 8.22779 7.5414 4.79852 7.42466 7.652 10.2623 5.0384 7.24908 numMergedOcc 0
49 mol 175 unq 2 iso 0 dist 7.652 9.92231 6.2715 5.0384 9.31887 12.816 7.24908 8.22779 10.5631 4.79852 7.42466 9.0018 5.6234 11.0415 9.8589 numMergedOcc 0
50 mol 175 unq 3 iso 0 dist 5.6234 9.92231 7.42466 10.5631 9.8589 7.24908 12.816 11.0415 5.0384 4.79852 6.2715 9.0018 7.652 8.22779 9.31887 numMergedOcc 0
51 mol 175 unq 4 iso 0 dist 9.92231 5.6234 7.42466 10.5631 7.24908 9.8589 12.816 5.0384 11.0415 4.79852 6.2715 7.652 9.0018 8.22779 9.31887 numMergedOcc 0
52 mol 181 unq 0 iso 0 dist 9.1374 8.03334 13.2049 6.25083 6.94688 12.1309 13.2702 8.25067 19.5806 8.20656 12.1628 9.15386 14.9794 6.80228 9.6668 numMergedOcc 0
53 mol 181 unq 1 iso 0 dist 9.1374 8.03334 13.2049 4.77278 6.71012 12.2058 13.2702 8.25067 19.5806 9.40622 12.1628 9.15386 14.9794 11.6919 9.6668 numMergedOcc 0
54 mol 181 unq 2 iso 0 dist 5.98885 9.09537 10.1912 5.86342 6.94688 14.4632 10.8351 8.25067 17.441 8.20656 5.16002 9.15386 12.9862 6.80228 9.6668 numMergedOcc 0
55 mol 181 unq 3 iso 0 dist 5.98885 9.09537 10.1912 9.14057 6.71012 15.4777 10.8351 8.25067 17.441 9.40622 5.16002 9.15386 12.9862 11.6919 9.6668 numMergedOcc 0
56 mol 224 unq 0 iso 0 dist 6.57273 6.60589 5.0744 7.12232 6.87664 10.8259 10.0414 9.36098 12.5195 8.89778 4.70378 8.95269 9.99123 7.98696 7.06793 numMergedOcc 0
57 mol 224 unq 1 iso 0 dist 6.57273 6.60589 5.0744 7.12232 6.87664 10.8259 6.65984 5.29877 6.12232 9.47554 4.70378 8.95269 9.99123 7.98696 6.67585 numMergedOcc 0
58 mol 224 unq 2 iso 0 dist 6.60589 6.65832 6.77699 6.12232 6.65984 11.0097 10.8259 7.12232 12.6949 9.47554 5.0744 6.57273 10.103 5.29877 6.87664 numMergedOcc 0
59 mol 224 unq 3 iso 0 dist 6.60589 9.16166 8.49799 6.12232 6.65984 10.667 10.8259 7.12232 5.3621 9.47554 5.0744 6.57273 5.78342 5.29877 6.87664 numMergedOcc 0
60 mol 224 unq 4 iso 0 dist 5.78342 9.16166 5.0744 5.3621 6.87664 10.8259 12.7072 9.36098 12.5195 8.89778 11.5372 8.95269 9.99123 7.98696 7.06793 numMergedOcc 0
61 mol 224 unq 5 iso 0 dist 5.78342 9.16166 5.0744 5.3621 6.87664 10.8259 10.667 5.29877 6.12232 9.47554 11.5372 8.95269 9.99123 7.98696 6.67585 numMergedOcc 0
62 mol 224 unq 6 iso 0 dist 5.78342 9.16166 5.0744 5.3621 6.87664 10.8259 10.667 5.29877 6.12232 9.47554 8.49799 6.57273 6.60589 7.12232 6.65984 numMergedOcc 0
63 mol 224 unq 7 iso 0 dist 5.78342 5.81334 5.60236 5.3621 6.87664 10.2775 12.7072 9.36098 14.7761 8.89778 11.5372 8.95269 14.0676 7.98696 7.06793 numMergedOcc 0
64 mol 224 unq 8 iso 0 dist 5.78342 5.81334 5.60236 5.3621 6.87664 10.2775 10.667 5.29877 10.449 9.47554 11.5372 8.95269 14.0676 7.98696 6.67585 numMergedOcc 0
65 mol 224 unq 9 iso 0 dist 5.78342 5.81334 5.60236 5.3621 6.87664 10.2775 10.667 5.29877 10.449 9.47554 8.49799 6.57273 10.5128 7.12232 6.65984 numMergedOcc 0
66 mol 234 unq 0 iso 0 dist 9.45496 6.56247 5.88703 15.9563 9.5707 10.3388 15.004 5.56749 10.6156 8.49841 19.022 10.3625 13.3467 5.9221 6.16063 numMergedOcc 0
67 mol 234 unq 1 iso 0 dist 6.7625 9.36357 5.88703 14.4106 9.5707 10.3388 10.8628 5.56749 10.6156 8.49841 16.0265 10.3625 13.3467 5.9221 6.16063 numMergedOcc 0
