0 mol 7 unq 0 iso 0 dist 6.22805 6.96396 7.10621 13.3157 10.515 9.36807 15.2825 10.5461 13.2247 6.36911 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.46752 5.66097 7.63133 9.47421 5.94084 5.47769 12.558 12.5273 6.92781 7.03948 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 7.46752 5.66097 7.63133 9.47421 5.94084 5.47769 6.06561 5.46498 5.32694 6.58035 numMergedOcc 0
3 mol 16 unq 2 iso 0 dist 7.46752 6.06561 5.46498 9.47421 5.94084 6.58035 12.558 12.5273 10.7015 7.03948 numMergedOcc 0
4 mol 16 unq 3 iso 0 dist 7.46752 6.06561 5.46498 9.47421 5.94084 6.58035 5.66097 7.63133 5.32694 5.47769 numMergedOcc 0
5 mol 16 unq 4 iso 0 dist 7.46752 6.06561 5.46498 12.3246 6.73355 8.41862 8.02077 8.71745 5.74188 8.16785 numMergedOcc 0
6 mol 16 unq 5 iso 0 dist 7.46752 8.02077 8.71745 12.3246 6.73355 8.16785 6.06561 5.46498 5.74188 8.41862 numMergedOcc 0
7 mol 19 unq 0 iso 0 dist 8.18518 14.1404 8.4674 12.7832 5.14627 6.20943 15.2051 9.78944 7.83352 6.00439 numMergedOcc 0
8 mol 19 unq 1 iso 0 dist 8.18518 14.1404 8.4674 12.7832 5.14627 6.20943 6.57145 4.54938 7.67038 7.82528 numMergedOcc 0
9 mol 19 unq 2 iso 0 dist 8.18518 6.57145 4.54938 5.36258 6.55187 8.23643 6.01189 7.82074 5.03957 8.73972 numMergedOcc 0
10 mol 19 unq 3 iso 0 dist 8.18518 6.57145 4.54938 12.7832 5.14627 7.82528 15.2051 9.78944 10.8007 6.00439 numMergedOcc 0
11 mol 19 unq 4 iso 0 dist 8.18518 6.57145 4.54938 12.7832 5.14627 7.82528 14.1404 8.4674 7.67038 6.20943 numMergedOcc 0
12 mol 19 unq 5 iso 0 dist 8.18518 6.01189 7.82074 5.36258 6.55187 8.73972 6.57145 4.54938 5.03957 8.23643 numMergedOcc 0
13 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 7.14313 10.0425 5.15851 5.2027 11.673 9.02771 6.33365 numMergedOcc 0
14 mol 75 unq 1 iso 0 dist 7.118 5.06305 7.79912 9.77241 10.0425 5.15851 11.3848 11.673 9.02771 6.33365 numMergedOcc 0
15 mol 75 unq 2 iso 0 dist 8.24814 5.06305 8.56639 9.77241 11.8774 5.15851 11.3848 15.657 9.02771 6.33365 numMergedOcc 0
16 mol 114 unq 0 iso 0 dist 9.24515 5.24877 7.5732 11.3006 5.80557 8.71128 8.47567 10.1027 5.59517 7.52743 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 7.44784 7.64822 7.30858 12.3154 11.3902 8.66155 9.97256 13.8473 7.69052 9.66954 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 9.56867 9.97256 6.11741 12.3154 4.61908 9.66954 7.64822 7.88312 7.69052 8.66155 numMergedOcc 0
19 mol 115 unq 2 iso 0 dist 9.56867 7.64822 7.88312 12.3154 4.61908 8.66155 9.97256 6.11741 7.69052 9.66954 numMergedOcc 0
20 mol 115 unq 3 iso 0 dist 6.09472 5.74878 4.99221 8.81198 5.60178 6.50039 12.0855 11.8322 10.4294 6.87861 numMergedOcc 0
21 mol 115 unq 4 iso 0 dist 8.93552 6.07331 4.99221 12.1661 5.60178 6.50039 16.1864 11.8322 10.4294 6.87861 numMergedOcc 0
22 mol 115 unq 5 iso 0 dist 6.20658 7.09627 4.99221 11.3523 5.60178 6.50039 16.3768 11.8322 10.4294 6.87861 numMergedOcc 0
23 mol 127 unq 0 iso 0 dist 6.65963 10.345 8.14887 18.5156 14.9761 8.59981 20.9551 19.0925 11.279 6.192 numMergedOcc 0
24 mol 127 unq 1 iso 0 dist 6.65963 10.345 8.14887 18.5156 14.9761 8.59981 19.6498 18.4772 11.4958 7.69308 numMergedOcc 0
25 mol 127 unq 2 iso 0 dist 6.65963 10.345 8.14887 18.5156 14.9761 8.59981 15.1726 12.8743 5.55757 7.66331 numMergedOcc 0
26 mol 127 unq 3 iso 0 dist 6.65963 10.345 8.14887 11.9686 7.41404 7.34519 15.1726 12.8743 5.55757 8.58999 numMergedOcc 0
27 mol 127 unq 4 iso 0 dist 6.65963 10.345 8.14887 11.9686 7.41404 7.34519 12.9049 11.3474 6.16471 6.63981 numMergedOcc 0
28 mol 127 unq 5 iso 0 dist 7.73139 11.0785 9.30299 17.6467 14.085 8.59981 18.8566 17.6472 11.279 6.192 numMergedOcc 0
29 mol 127 unq 6 iso 0 dist 7.73139 11.0785 9.30299 17.6467 14.085 8.59981 16.1067 15.0647 11.4958 7.69308 numMergedOcc 0
30 mol 127 unq 7 iso 0 dist 7.73139 11.0785 9.30299 17.6467 14.085 8.59981 15.9321 14.7391 5.55757 7.66331 numMergedOcc 0
31 mol 127 unq 8 iso 0 dist 7.73139 11.0785 9.30299 16.0863 13.1312 7.34519 15.9321 14.7391 5.55757 8.58999 numMergedOcc 0
32 mol 127 unq 9 iso 0 dist 7.73139 11.0785 9.30299 16.0863 13.1312 7.34519 15.2222 14.9565 6.16471 6.63981 numMergedOcc 0
33 mol 127 unq 10 iso 0 dist 6.66607 8.89539 9.30299 10.9741 14.085 8.59981 12.7592 17.6472 11.279 6.192 numMergedOcc 0
34 mol 127 unq 11 iso 0 dist 6.66607 8.89539 9.30299 10.9741 14.085 8.59981 9.03743 15.0647 11.4958 7.69308 numMergedOcc 0
35 mol 127 unq 12 iso 0 dist 6.66607 8.89539 9.30299 10.9741 14.085 8.59981 13.0163 14.7391 5.55757 7.66331 numMergedOcc 0
36 mol 127 unq 13 iso 0 dist 6.66607 8.89539 9.30299 15.4483 13.1312 7.34519 13.0163 14.7391 5.55757 8.58999 numMergedOcc 0
37 mol 127 unq 14 iso 0 dist 6.66607 8.89539 9.30299 15.4483 13.1312 7.34519 14.7761 14.9565 6.16471 6.63981 numMergedOcc 0
38 mol 127 unq 15 iso 0 dist 8.62711 10.345 9.30299 18.5156 14.085 8.59981 20.9551 17.6472 11.279 6.192 numMergedOcc 0
39 mol 127 unq 16 iso 0 dist 8.62711 10.345 9.30299 18.5156 14.085 8.59981 19.6498 15.0647 11.4958 7.69308 numMergedOcc 0
40 mol 127 unq 17 iso 0 dist 8.62711 10.345 9.30299 18.5156 14.085 8.59981 15.1726 14.7391 5.55757 7.66331 numMergedOcc 0
41 mol 127 unq 18 iso 0 dist 8.62711 10.345 9.30299 11.9686 13.1312 7.34519 15.1726 14.7391 5.55757 8.58999 numMergedOcc 0
42 mol 127 unq 19 iso 0 dist 8.62711 10.345 9.30299 11.9686 13.1312 7.34519 12.9049 14.9565 6.16471 6.63981 numMergedOcc 0
43 mol 155 unq 0 iso 0 dist 7.28355 4.8645 6.23493 11.7713 4.9093 9.17284 14.9875 12.1555 10.6882 9.87281 numMergedOcc 0
44 mol 155 unq 1 iso 0 dist 7.28355 4.8645 6.23493 11.7713 4.9093 9.17284 15.5253 11.6934 12.1545 8.87452 numMergedOcc 0
45 mol 175 unq 0 iso 0 dist 6.73365 5.73338 5.6234 15.0771 10.5631 9.8589 12.753 9.92231 7.42466 7.24908 numMergedOcc 0
46 mol 175 unq 1 iso 0 dist 6.73365 12.753 9.92231 15.0771 10.5631 7.24908 5.73338 5.6234 7.42466 9.8589 numMergedOcc 0
47 mol 175 unq 2 iso 0 dist 9.45659 5.73338 6.57069 15.0771 7.5414 9.8589 12.753 10.2623 7.42466 7.24908 numMergedOcc 0
48 mol 214 unq 0 iso 0 dist 9.40003 16.922 8.85478 13.7287 6.67959 7.46831 14.6958 11.9355 10.3105 8.60247 numMergedOcc 0
49 mol 214 unq 1 iso 0 dist 8.68385 9.18071 8.85478 10.7631 6.67959 7.46831 17.7458 11.9355 10.3105 8.60247 numMergedOcc 0
50 mol 236 unq 0 iso 0 dist 6.73134 5.27568 8.35971 5.77356 6.40312 7.17676 7.77821 11.2141 7.28249 5.34718 numMergedOcc 0
51 mol 238 unq 0 iso 0 dist 7.98022 6.3873 5.72887 14.7533 13.069 9.29858 16.1308 12.8711 10.1648 9.68513 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 6.96379 12.7595 7.88519 15.1733 11.6195 7.48005 15.9497 15.9169 12.5353 8.37865 numMergedOcc 0
