0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 12.0193 5.99972 10.6471 13.2247 12.2333 9.36807 12.4827 10.5461 12.2041 10.515 11.2662 7.10621 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 9.36807 10.515 13.8829 8.72114 9.97624 13.2247 10.5461 6.36911 5.03847 12.2333 12.2041 6.06176 10.3148 8.41585 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 8.38064 8.21493 5.90976 4.39605 7.48342 10.0974 9.03536 9.97507 7.12903 12.1303 10.4158 5.17568 5.51916 11.2317 6.82505 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 5.05803 7.03948 6.2983 5.30082 6.93532 11.7521 6.92781 6.31718 5.47769 10.4366 12.5273 10.8455 5.94084 16.9082 7.63133 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 5.05803 7.03948 6.2983 5.30082 6.93532 11.7521 10.7015 10.9143 6.58035 15.1671 12.5273 10.8455 5.94084 16.9082 5.46498 numMergedOcc 0
5 mol 16 unq 2 iso 0 dist 6.31718 5.47769 6.2983 10.4366 6.93532 11.7521 5.32694 10.9143 6.58035 15.1671 7.63133 10.8455 5.94084 16.9082 5.46498 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 7.20519 9.80108 5.5841 4.96411 7.75618 7.02548 7.07775 6.864 8.58657 7.08342 10.4091 7.67038 6.74265 8.40416 4.51865 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 8.4674 6.20943 5.14627 4.64838 6.41575 5.82366 7.67038 4.54938 7.82528 4.97119 10.4091 7.34551 10.4988 10.741 7.20519 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 8.4674 6.20943 5.14627 4.64838 6.41575 5.82366 7.67038 4.54938 7.82528 4.97119 4.51865 5.80928 4.69858 6.41423 6.864 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 4.54938 7.82528 5.14627 4.97119 6.41575 5.82366 7.67038 8.4674 6.20943 4.64838 6.864 5.80928 4.69858 6.41423 4.51865 numMergedOcc 0
10 mol 19 unq 4 iso 0 dist 7.82074 8.73972 6.55187 6.01808 6.41575 11.3136 5.03957 4.54938 8.23643 4.97119 12.1187 7.34551 11.0832 10.741 7.20519 numMergedOcc 0
11 mol 19 unq 5 iso 0 dist 7.82074 8.73972 6.55187 6.01808 6.41575 11.3136 5.03957 4.54938 8.23643 4.97119 11.0366 5.80928 12.3093 6.41423 6.864 numMergedOcc 0
12 mol 19 unq 6 iso 0 dist 4.51865 6.20943 4.69858 4.64838 6.41423 5.82366 7.67038 6.864 7.82528 4.97119 10.4091 7.07775 10.4988 10.741 7.20519 numMergedOcc 0
13 mol 19 unq 7 iso 0 dist 4.51865 6.20943 4.69858 4.64838 6.41423 5.82366 7.67038 6.864 7.82528 4.97119 8.4674 5.80928 5.14627 6.41575 4.54938 numMergedOcc 0
14 mol 19 unq 8 iso 0 dist 4.51865 8.58657 6.74265 7.08342 8.40416 7.02548 7.07775 10.4091 9.80108 4.96411 6.864 7.67038 5.5841 7.75618 7.20519 numMergedOcc 0
15 mol 19 unq 9 iso 0 dist 6.864 8.23643 12.3093 4.97119 6.41423 11.3136 5.03957 11.0366 8.73972 6.01808 4.54938 5.80928 6.55187 6.41575 7.82074 numMergedOcc 0
16 mol 19 unq 10 iso 0 dist 6.864 7.82528 4.69858 4.97119 6.41423 5.82366 7.67038 4.51865 6.20943 4.64838 4.54938 5.80928 5.14627 6.41575 8.4674 numMergedOcc 0
17 mol 58 unq 0 iso 0 dist 7.32874 6.40841 6.75888 7.12541 7.21955 8.71468 11.0466 13.4544 7.58407 11.387 11.396 10.6169 5.11205 12.3035 6.64012 numMergedOcc 0
18 mol 58 unq 1 iso 0 dist 7.32874 6.40841 6.75888 7.12541 7.21955 8.71468 5.90225 9.55426 6.31428 5.74871 11.396 10.6169 5.11205 12.3035 9.4099 numMergedOcc 0
19 mol 58 unq 2 iso 0 dist 6.86465 8.63333 6.47744 10.2049 8.80614 9.11258 10.8153 10.3224 6.46761 5.85698 13.497 9.94737 5.24906 9.86039 6.64012 numMergedOcc 0
20 mol 58 unq 3 iso 0 dist 6.86465 8.63333 6.47744 10.2049 8.80614 9.11258 14.5953 15.4557 9.73139 12.2123 13.497 9.94737 5.24906 9.86039 9.4099 numMergedOcc 0
21 mol 58 unq 4 iso 0 dist 6.86465 8.63333 6.47744 10.2049 8.80614 9.11258 14.5953 15.4557 9.73139 12.2123 20.7459 19.4068 13.1021 18.8985 9.55426 numMergedOcc 0
22 mol 58 unq 5 iso 0 dist 6.35756 8.89374 6.47744 5.49591 8.80614 9.11258 8.62958 10.3224 6.46761 5.85698 12.1902 9.94737 5.24906 9.86039 6.64012 numMergedOcc 0
23 mol 58 unq 6 iso 0 dist 6.35756 8.89374 6.47744 5.49591 8.80614 9.11258 14.176 15.4557 9.73139 12.2123 12.1902 9.94737 5.24906 9.86039 9.4099 numMergedOcc 0
24 mol 58 unq 7 iso 0 dist 6.35756 8.89374 6.47744 5.49591 8.80614 9.11258 14.176 15.4557 9.73139 12.2123 20.984 19.4068 13.1021 18.8985 9.55426 numMergedOcc 0
25 mol 58 unq 8 iso 0 dist 9.55426 9.73139 13.1021 5.74871 7.21955 14.2645 14.5953 20.7459 8.63333 20.2165 15.4557 19.4068 6.47744 20.3799 6.86465 numMergedOcc 0
26 mol 58 unq 9 iso 0 dist 9.55426 9.73139 13.1021 5.74871 7.21955 14.2645 14.176 20.984 8.89374 19.69 15.4557 19.4068 6.47744 20.3799 6.35756 numMergedOcc 0
27 mol 58 unq 10 iso 0 dist 9.55426 9.73139 13.1021 5.74871 7.21955 14.2645 6.47414 13.4544 6.46761 11.387 9.4099 10.6169 5.24906 12.3035 6.64012 numMergedOcc 0
28 mol 58 unq 11 iso 0 dist 9.55426 6.31428 6.75888 5.74871 7.21955 8.71468 6.47414 13.4544 7.58407 11.387 9.4099 10.6169 5.11205 12.3035 6.64012 numMergedOcc 0
29 mol 73 unq 0 iso 0 dist 9.96396 8.70133 7.41074 5.11416 9.24757 7.10439 7.4697 11.4799 5.64598 8.44406 13.1662 16.5689 9.77992 13.6162 5.93252 numMergedOcc 0
30 mol 73 unq 1 iso 0 dist 6.19304 4.65521 7.41074 6.56633 9.24757 7.10439 5.4148 9.96396 8.70133 5.11416 10.2049 15.7123 13.4082 13.8696 9.38498 numMergedOcc 0
31 mol 73 unq 2 iso 0 dist 6.19304 4.65521 7.41074 6.56633 9.24757 7.10439 5.4148 9.96396 8.70133 5.11416 11.6369 12.016 15.9882 13.0145 9.75218 numMergedOcc 0
32 mol 73 unq 3 iso 0 dist 6.19304 4.65521 7.41074 6.56633 9.24757 7.10439 5.7113 11.4799 5.64598 8.44406 11.379 16.5689 9.77992 13.6162 5.93252 numMergedOcc 0
33 mol 85 unq 0 iso 0 dist 7.97049 9.47876 7.98917 9.29301 9.82915 10.0297 6.9948 7.47541 7.22293 13.5116 6.19965 5.42586 11.6116 12.0078 7.66905 numMergedOcc 0
34 mol 85 unq 1 iso 0 dist 7.97049 9.47876 7.98917 9.29301 9.82915 10.0297 6.9948 7.47541 7.22293 13.5116 11.2656 6.87425 6.47779 14.4382 5.73196 numMergedOcc 0
35 mol 85 unq 2 iso 0 dist 7.47541 7.22293 7.98917 13.5116 9.82915 10.0297 6.9948 7.97049 9.47876 9.29301 7.66905 5.42586 11.6116 12.0078 6.19965 numMergedOcc 0
36 mol 85 unq 3 iso 0 dist 6.19965 9.47876 11.6116 8.09967 7.54568 11.8261 6.9948 7.66905 7.22293 4.65335 7.97049 5.42586 7.98917 10.0796 7.47541 numMergedOcc 0
37 mol 85 unq 4 iso 0 dist 6.19965 9.47876 11.6116 8.09967 7.54568 11.8261 6.9948 7.66905 7.22293 4.65335 11.2656 10.1164 6.47779 9.39864 5.73196 numMergedOcc 0
38 mol 85 unq 5 iso 0 dist 7.66905 7.22293 11.6116 4.65335 7.54568 11.8261 6.9948 6.19965 9.47876 8.09967 7.47541 5.42586 7.98917 10.0796 7.97049 numMergedOcc 0
39 mol 85 unq 6 iso 0 dist 5.73196 7.22293 6.47779 4.65335 9.39864 11.8261 6.9948 11.2656 9.47876 8.09967 7.47541 6.87425 7.98917 10.0796 7.97049 numMergedOcc 0
40 mol 85 unq 7 iso 0 dist 5.73196 7.22293 6.47779 4.65335 9.39864 11.8261 6.9948 11.2656 9.47876 8.09967 7.66905 10.1164 11.6116 7.54568 6.19965 numMergedOcc 0
41 mol 100 unq 0 iso 0 dist 7.17106 6.58204 5.01145 10.6848 7.10378 11.9163 5.88134 10.5134 7.75343 15.3454 12.0662 17.5254 15.209 21.075 7.47343 numMergedOcc 0
42 mol 100 unq 1 iso 0 dist 7.17106 6.58204 5.01145 10.6848 7.10378 11.9163 5.88134 10.5134 7.75343 15.3454 9.60661 11.5403 10.9608 14.8081 6.65086 numMergedOcc 0
43 mol 100 unq 2 iso 0 dist 7.17106 6.58204 5.01145 10.6848 7.10378 11.9163 5.88134 10.5134 7.75343 15.3454 9.35224 8.87654 5.69137 15.2289 6.56369 numMergedOcc 0
44 mol 100 unq 3 iso 0 dist 7.17106 6.58204 5.01145 10.6848 7.10378 11.9163 5.88134 10.5134 7.75343 15.3454 10.5853 8.7812 9.21622 12.6004 9.30209 numMergedOcc 0
45 mol 100 unq 4 iso 0 dist 7.47343 7.75343 15.209 11.2312 7.38135 18.081 5.88134 12.0662 6.58204 14.2012 6.65086 8.8807 10.9608 15.4031 9.60661 numMergedOcc 0
46 mol 100 unq 5 iso 0 dist 7.47343 7.75343 15.209 11.2312 7.38135 18.081 5.88134 12.0662 6.58204 14.2012 10.5134 17.5254 5.01145 20.9247 7.17106 numMergedOcc 0
47 mol 100 unq 6 iso 0 dist 7.47343 7.75343 15.209 11.2312 7.38135 18.081 5.88134 12.0662 6.58204 14.2012 6.56369 12.6515 5.69137 17.2419 9.35224 numMergedOcc 0
48 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 7.20179 6.52773 11.8717 12.4603 12.6489 7.44174 10.9441 10.3704 4.85907 7.36192 9.11344 9.87172 numMergedOcc 0
49 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 9.89358 9.23858 15.8603 12.4603 12.6489 7.44174 20.1288 10.3704 4.85907 7.36192 12.7677 9.87172 numMergedOcc 0
50 mol 119 unq 2 iso 0 dist 9.87172 6.19042 6.35763 10.9441 9.11344 11.1099 9.22558 10.1813 8.43904 6.42402 13.9919 10.9871 10.3457 9.87889 6.18601 numMergedOcc 0
51 mol 119 unq 3 iso 0 dist 9.87172 7.44174 7.36192 10.9441 9.11344 11.8717 12.4603 10.3704 9.63176 7.20179 12.6489 4.85907 10.6679 6.52773 8.73993 numMergedOcc 0
52 mol 119 unq 4 iso 0 dist 6.18601 8.43904 10.3457 10.4376 8.00003 16.109 9.22558 13.9919 6.19042 18.5424 10.1813 10.9871 6.35763 13.7362 9.87172 numMergedOcc 0
53 mol 134 unq 0 iso 0 dist 6.54501 8.6355 10.1448 5.71679 7.69991 8.73604 8.80819 11.9139 8.79571 4.57832 6.49416 5.00526 5.41704 6.23142 8.94367 numMergedOcc 0
54 mol 134 unq 1 iso 0 dist 6.54501 8.6355 10.1448 5.71679 7.69991 8.73604 8.80819 11.9139 8.79571 4.57832 12.5075 11.3271 6.17103 9.94764 9.86662 numMergedOcc 0
55 mol 134 unq 2 iso 0 dist 6.54501 8.6355 10.1448 5.71679 7.69991 8.73604 5.00817 9.5126 5.42582 5.29786 6.49416 5.00526 5.41704 6.23142 6.37586 numMergedOcc 0
56 mol 134 unq 3 iso 0 dist 6.54501 8.6355 10.1448 5.71679 7.69991 8.73604 5.00817 9.5126 5.42582 5.29786 12.5075 11.3271 6.17103 9.94764 9.71307 numMergedOcc 0
57 mol 134 unq 4 iso 0 dist 8.94367 8.79571 5.41704 4.57832 6.23142 8.73604 5.49782 6.37586 5.42582 5.29786 9.86662 6.81259 6.17103 9.94764 9.71307 numMergedOcc 0
58 mol 134 unq 5 iso 0 dist 8.94367 8.79571 5.41704 4.57832 6.23142 8.73604 8.80819 6.49416 8.6355 5.71679 11.9139 5.00526 10.1448 7.69991 6.54501 numMergedOcc 0
59 mol 134 unq 6 iso 0 dist 6.37586 5.42582 5.41704 5.29786 6.23142 8.73604 5.49782 8.94367 8.79571 4.57832 9.71307 6.81259 6.17103 9.94764 9.86662 numMergedOcc 0
60 mol 134 unq 7 iso 0 dist 6.37586 5.42582 5.41704 5.29786 6.23142 8.73604 5.00817 6.49416 8.6355 5.71679 9.5126 5.00526 10.1448 7.69991 6.54501 numMergedOcc 0
61 mol 134 unq 8 iso 0 dist 6.49416 8.6355 5.41704 5.71679 6.23142 8.73604 8.80819 8.94367 8.79571 4.57832 12.5075 6.81259 6.17103 9.94764 9.86662 numMergedOcc 0
62 mol 134 unq 9 iso 0 dist 6.49416 8.6355 5.41704 5.71679 6.23142 8.73604 5.00817 6.37586 5.42582 5.29786 12.5075 6.81259 6.17103 9.94764 9.71307 numMergedOcc 0
63 mol 134 unq 10 iso 0 dist 9.86662 8.79571 6.17103 4.57832 9.94764 8.73604 5.49782 9.71307 5.42582 5.29786 8.94367 6.81259 5.41704 6.23142 6.37586 numMergedOcc 0
64 mol 134 unq 11 iso 0 dist 9.86662 8.79571 6.17103 4.57832 9.94764 8.73604 8.80819 12.5075 8.6355 5.71679 11.9139 11.3271 10.1448 7.69991 6.54501 numMergedOcc 0
65 mol 134 unq 12 iso 0 dist 9.86662 8.79571 6.17103 4.57832 9.94764 8.73604 8.80819 12.5075 8.6355 5.71679 8.94367 6.81259 5.41704 6.23142 6.49416 numMergedOcc 0
66 mol 134 unq 13 iso 0 dist 9.71307 5.42582 6.17103 5.29786 9.94764 8.73604 5.49782 9.86662 8.79571 4.57832 6.37586 6.81259 5.41704 6.23142 8.94367 numMergedOcc 0
67 mol 134 unq 14 iso 0 dist 9.71307 5.42582 6.17103 5.29786 9.94764 8.73604 5.00817 12.5075 8.6355 5.71679 9.5126 11.3271 10.1448 7.69991 6.54501 numMergedOcc 0
68 mol 134 unq 15 iso 0 dist 9.71307 5.42582 6.17103 5.29786 9.94764 8.73604 5.00817 12.5075 8.6355 5.71679 6.37586 6.81259 5.41704 6.23142 6.49416 numMergedOcc 0
69 mol 155 unq 0 iso 0 dist 6.43582 9.14392 12.1814 5.50031 7.92304 13.3276 5.71071 10.2463 7.16254 11.0769 7.46303 7.66392 6.3845 12.2416 6.23493 numMergedOcc 0
70 mol 155 unq 1 iso 0 dist 6.43582 7.51198 6.34186 5.50031 7.92304 9.80845 5.71071 10.2463 9.86313 11.0769 7.46303 7.66392 5.86939 12.2416 6.23493 numMergedOcc 0
71 mol 175 unq 0 iso 0 dist 6.57069 9.8589 7.5414 8.29015 9.77896 5.4997 7.42466 10.2623 7.24908 4.63177 9.0018 8.16421 8.22779 10.4182 7.652 numMergedOcc 0
72 mol 175 unq 1 iso 0 dist 6.57069 9.8589 7.5414 8.29015 9.77896 5.4997 7.42466 10.2623 7.24908 4.63177 5.6234 5.35493 10.5631 11.6765 9.92231 numMergedOcc 0
73 mol 227 unq 0 iso 0 dist 8.65997 6.95902 6.43754 10.204 7.43071 12.2922 5.22356 7.22101 8.17891 6.35849 10.8157 4.39704 9.13836 6.02296 7.09863 numMergedOcc 0
74 mol 227 unq 1 iso 0 dist 8.65997 6.95902 6.43754 9.72615 5.41321 7.57454 5.22356 7.22101 8.17891 10.9607 10.8157 4.39704 9.13836 9.74265 7.09863 numMergedOcc 0
75 mol 227 unq 2 iso 0 dist 7.09863 8.17891 9.13836 6.35849 6.02296 12.2922 5.22356 10.8157 6.95902 10.204 7.22101 4.39704 6.43754 7.43071 8.65997 numMergedOcc 0
76 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 8.81835 7.98231 8.71497 12.5353 15.9169 8.37865 8.75685 12.0576 15.8535 5.31048 10.4552 5.30224 numMergedOcc 0
77 mol 259 unq 1 iso 0 dist 7.46176 7.48005 5.79468 8.81835 7.08526 8.71497 12.5353 11.858 8.37865 8.75685 12.0576 9.98105 5.31048 10.4552 5.30224 numMergedOcc 0
