0 mol 7 unq 0 iso 0 dist 6.36911 9.68596 13.0969 5.03847 9.97624 6.14469 10.6581 15.9584 6.55304 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.36911 9.68596 13.0969 5.03847 9.97624 6.14469 10.5461 10.515 6.34041 8.72114 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.53002 4.30695 11.9464 10.9183 8.73067 13.8519 14.7815 8.05213 17.3716 5.96346 numMergedOcc 0
3 mol 11 unq 1 iso 0 dist 9.53002 6.35398 7.5901 10.9183 8.73067 7.98326 14.7815 8.05213 10.7734 5.96346 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 9.29358 5.89412 6.19131 9.75966 6.50647 6.03257 11.3543 6.67334 10.1154 6.42748 numMergedOcc 0
5 mol 15 unq 1 iso 0 dist 9.29358 5.89412 6.19131 9.75966 6.50647 6.03257 9.88835 6.29685 4.29582 7.48342 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 6.20943 8.40416 11.4087 4.64838 5.82366 9.95212 8.4674 5.14627 9.74255 6.41575 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 6.20943 8.40416 11.4087 4.64838 5.82366 9.95212 4.51865 4.69858 7.08342 6.41423 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 7.82528 7.75618 11.4087 4.97119 5.82366 9.95212 4.54938 5.14627 9.74255 6.41575 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 7.82528 7.75618 11.4087 4.97119 5.82366 9.95212 6.864 4.69858 7.08342 6.41423 numMergedOcc 0
10 mol 19 unq 4 iso 0 dist 8.58657 6.41423 5.90856 7.08342 7.02548 9.95212 4.51865 6.74265 4.64838 8.40416 numMergedOcc 0
11 mol 19 unq 5 iso 0 dist 8.58657 6.41423 5.90856 7.08342 7.02548 9.95212 6.864 5.5841 4.97119 7.75618 numMergedOcc 0
12 mol 54 unq 0 iso 0 dist 5.02241 7.21717 11.0681 4.29856 6.30987 10.7227 6.83299 5.06052 13.86 6.14538 numMergedOcc 0
13 mol 58 unq 0 iso 0 dist 8.63333 9.92355 12.0055 10.2049 9.11258 10.2007 6.86465 6.47744 5.78774 8.80614 numMergedOcc 0
14 mol 58 unq 1 iso 0 dist 8.89374 7.68678 12.0055 5.49591 9.11258 10.2007 6.35756 6.47744 5.78774 8.80614 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.6355 7.80532 14.1488 5.71679 8.73604 6.40575 6.54501 10.1448 7.41674 7.69991 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 8.6355 7.80532 14.1488 5.71679 8.73604 6.40575 6.49416 5.41704 9.87376 6.23142 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 8.6355 7.80532 14.1488 5.71679 8.73604 6.40575 12.5075 6.17103 14.9876 9.94764 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 6.88137 8.73722 5.69209 6.14767 7.30946 5.41575 10.2717 5.07967 5.52796 7.30357 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 7.36119 7.30357 11.9671 5.81563 6.05323 8.21184 11.6719 8.31653 10.8404 9.00416 numMergedOcc 0
20 mol 156 unq 2 iso 0 dist 7.36119 8.61587 8.69711 5.81563 6.05323 5.9976 11.6719 8.31653 5.18356 9.00416 numMergedOcc 0
21 mol 156 unq 3 iso 0 dist 6.27641 9.4013 5.05683 5.4555 5.81122 8.37434 7.44554 7.29758 5.71511 9.44367 numMergedOcc 0
22 mol 156 unq 4 iso 0 dist 6.27641 9.4013 5.05683 5.4555 5.81122 8.37434 8.94056 8.67156 6.13574 7.90267 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 6.94688 8.90963 4.43678 6.6251 9.06217 12.1629 9.1374 6.25083 8.91338 6.2479 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 6.94688 8.90963 4.43678 6.6251 9.06217 12.1629 9.94371 10.5753 11.85 6.22122 numMergedOcc 0
25 mol 181 unq 2 iso 0 dist 6.94688 8.90963 4.43678 6.6251 9.06217 12.1629 5.98885 5.86342 9.81073 7.99195 numMergedOcc 0
26 mol 181 unq 3 iso 0 dist 6.71012 8.90963 6.03415 6.6251 7.13252 12.1629 9.1374 4.77278 8.91338 6.2479 numMergedOcc 0
27 mol 181 unq 4 iso 0 dist 6.71012 8.90963 6.03415 6.6251 7.13252 12.1629 9.94371 5.88819 11.85 6.22122 numMergedOcc 0
28 mol 181 unq 5 iso 0 dist 6.71012 8.90963 6.03415 6.6251 7.13252 12.1629 5.98885 9.14057 9.81073 7.99195 numMergedOcc 0
29 mol 181 unq 6 iso 0 dist 7.13543 9.72611 14.6648 5.77299 6.32777 15.3124 10.7062 7.07409 18.696 6.59025 numMergedOcc 0
30 mol 181 unq 7 iso 0 dist 7.13543 7.99195 7.23063 5.77299 6.32777 8.86197 10.7062 7.07409 7.81713 6.59025 numMergedOcc 0
31 mol 181 unq 8 iso 0 dist 7.98142 5.94469 8.93991 5.63555 5.97685 10.3104 7.63312 9.60512 12.5387 5.9176 numMergedOcc 0
32 mol 181 unq 9 iso 0 dist 7.37327 5.94469 5.35588 5.63555 8.9289 10.3104 7.63312 13.3389 12.5387 5.9176 numMergedOcc 0
33 mol 181 unq 10 iso 0 dist 4.93785 9.39829 7.30555 7.77758 7.05653 11.8933 7.81386 6.7991 7.20191 5.94469 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 10.7081 8.09718 10.6756 13.9668 13.171 8.1195 7.57812 numMergedOcc 0
35 mol 238 unq 1 iso 0 dist 6.05141 8.94014 11.5793 10.7081 8.09718 10.6756 16.4238 11.9142 15.0391 9.24557 numMergedOcc 0
36 mol 238 unq 2 iso 0 dist 6.05141 8.94014 11.5793 5.50308 6.73446 5.92374 13.9668 13.171 8.1195 8.69104 numMergedOcc 0
37 mol 238 unq 3 iso 0 dist 8.14172 7.02333 4.38002 12.2874 8.90076 10.6756 12.8275 5.11565 8.1195 7.57812 numMergedOcc 0
38 mol 238 unq 4 iso 0 dist 8.14172 7.02333 4.38002 12.2874 8.90076 10.6756 15.1497 11.0401 15.0391 9.24557 numMergedOcc 0
39 mol 238 unq 5 iso 0 dist 8.14172 7.02333 4.38002 7.11984 6.62002 5.92374 12.8275 5.11565 8.1195 8.69104 numMergedOcc 0
40 mol 238 unq 6 iso 0 dist 8.09066 7.02333 11.5793 12.2874 8.09718 10.6756 12.8275 13.171 8.1195 7.57812 numMergedOcc 0
41 mol 238 unq 7 iso 0 dist 8.09066 7.02333 11.5793 12.2874 8.09718 10.6756 15.1497 11.9142 15.0391 9.24557 numMergedOcc 0
42 mol 238 unq 8 iso 0 dist 8.09066 7.02333 11.5793 7.11984 6.73446 5.92374 12.8275 13.171 8.1195 8.69104 numMergedOcc 0
43 mol 238 unq 9 iso 0 dist 6.77463 8.67864 4.38002 10.4017 8.90076 10.6756 10.7456 5.11565 8.1195 7.57812 numMergedOcc 0
44 mol 238 unq 10 iso 0 dist 6.77463 8.67864 4.38002 10.4017 8.90076 10.6756 10.3007 11.0401 15.0391 9.24557 numMergedOcc 0
45 mol 238 unq 11 iso 0 dist 6.77463 8.67864 4.38002 7.95232 6.62002 5.92374 10.7456 5.11565 8.1195 8.69104 numMergedOcc 0
46 mol 238 unq 12 iso 0 dist 7.2766 8.67864 11.5793 10.4017 8.09718 10.6756 10.7456 13.171 8.1195 7.57812 numMergedOcc 0
47 mol 238 unq 13 iso 0 dist 7.2766 8.67864 11.5793 10.4017 8.09718 10.6756 10.3007 11.9142 15.0391 9.24557 numMergedOcc 0
48 mol 238 unq 14 iso 0 dist 7.2766 8.67864 11.5793 7.95232 6.73446 5.92374 10.7456 13.171 8.1195 8.69104 numMergedOcc 0
49 mol 264 unq 0 iso 0 dist 9.0012 7.16853 9.76317 7.52936 5.91213 10.3854 6.24356 5.12409 5.00209 5.93616 numMergedOcc 0
50 mol 264 unq 1 iso 0 dist 9.5784 7.16853 13.9064 7.52936 7.34094 10.3854 6.24356 9.67998 5.00209 5.93616 numMergedOcc 0
